#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i43 s ALA 51 N 0.00 3.74 -0.11 2.98 0.00 -1.26 -5.03 121.76 122.07 1i43 s ALA 51 Ca 0.00 -1.20 -0.23 0.00 0.00 0.00 0.00 51.96 50.53 1i43 s ALA 51 Cb 0.00 -1.52 -0.27 0.00 0.00 0.00 0.00 23.12 21.33 1i43 s ALA 51 CO 0.00 0.43 0.71 0.66 0.00 0.00 0.00 175.76 177.56 1i43 h SER 52 N 2.00 0.24 0.17 0.00 4.64 -2.05 -3.27 113.55 115.28 1i43 h SER 52 Ca -0.49 -0.90 0.00 0.00 -0.47 0.00 0.00 61.79 59.94 1i43 h SER 52 Cb 1.21 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1i43 h SER 52 CO 0.64 1.32 0.00 2.22 -0.87 0.00 0.00 176.83 180.14 1i43 n PHE 53 N -4.28 0.22 -3.57 4.77 1.16 -1.26 -4.05 117.46 110.45 1i43 n PHE 53 Ca -0.17 0.11 -0.41 0.00 -1.87 0.00 0.00 57.45 55.11 1i43 n PHE 53 Cb 0.71 -0.67 -0.08 0.00 -1.61 0.00 0.00 39.48 37.82 1i43 n PHE 53 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1i43 s LEU 54 N -3.44 5.71 -0.09 5.98 1.43 -1.23 -4.89 118.68 122.15 1i43 s LEU 54 Ca 0.01 -2.09 0.16 0.00 -1.03 0.00 0.00 54.13 51.18 1i43 s LEU 54 Cb 0.04 -2.00 -0.24 0.00 0.03 0.00 0.00 46.19 44.02 1i43 s LEU 54 CO 0.13 -0.64 0.23 0.59 0.23 0.00 0.00 176.35 176.89 1i43 n ASN 55 N 4.65 1.02 -4.87 2.29 3.02 -1.26 -4.64 115.26 115.47 1i43 n ASN 55 Ca -0.04 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.19 1i43 n ASN 55 Cb 0.41 1.38 -0.05 0.00 -0.61 0.00 0.00 39.78 40.91 1i43 n ASN 55 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1i43 s SER 56 N -4.46 6.63 0.36 6.41 0.15 -1.26 -4.98 113.70 116.55 1i43 s SER 56 Ca -0.07 0.99 0.07 0.00 0.70 0.00 0.00 55.95 57.64 1i43 s SER 56 Cb 0.08 -2.25 0.69 0.00 -1.71 0.00 0.00 66.02 62.83 1i43 s SER 56 CO 0.70 -0.13 1.88 0.44 1.20 0.00 0.00 173.24 177.33 1i43 h ASP 57 N 2.35 0.34 -0.50 5.45 3.32 -1.99 -2.48 116.42 122.89 1i43 h ASP 57 Ca -0.47 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 56.48 1i43 h ASP 57 Cb 1.17 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 1i43 h ASP 57 CO 0.68 0.47 0.19 1.23 -1.72 0.00 0.00 179.24 180.09 1i43 h GLY 58 N 0.80 0.82 1.74 2.75 0.00 -1.98 0.10 103.07 107.30 1i43 h GLY 58 Ca 0.07 -0.45 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1i43 h GLY 58 CO 0.02 0.43 -0.19 1.76 0.00 0.00 0.00 176.54 178.56 1i43 h SER 59 N 0.68 0.31 0.17 0.19 0.02 -1.90 -2.93 113.55 110.09 1i43 h SER 59 Ca 0.17 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1i43 h SER 59 Cb 0.21 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1i43 h SER 59 CO -0.01 0.52 -0.08 0.58 -1.14 0.00 0.00 176.83 176.69 1i43 h VAL 60 N 0.29 0.91 0.00 2.27 2.07 -1.00 -1.85 116.25 118.95 1i43 h VAL 60 Ca 0.05 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1i43 h VAL 60 Cb 0.51 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1i43 h VAL 60 CO 0.03 0.21 0.32 0.00 0.02 0.00 0.00 177.57 178.15 1i43 h ALA 61 N -0.12 1.22 0.00 1.67 0.00 -0.69 0.57 119.26 121.90 1i43 h ALA 61 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.50 1i43 h ALA 61 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 1i43 h ALA 61 CO 0.04 -0.22 -2.23 -0.89 0.00 0.00 0.00 179.25 175.95 1i43 n ILE 62 N -2.10 1.52 0.93 0.00 5.41 -1.12 -4.13 119.36 119.88 1i43 n ILE 62 Ca -0.01 -0.28 0.11 0.00 1.00 0.00 0.00 62.75 63.56 1i43 n ILE 62 Cb 0.34 -1.96 0.05 0.00 -0.71 0.00 0.00 39.64 37.35 1i43 n ILE 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1i43 n HIS 63 N -4.30 0.00 -1.83 1.39 8.25 -0.71 -4.89 115.22 113.14 1i43 n HIS 63 Ca -0.47 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.56 1i43 n HIS 63 Cb 0.82 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.90 1i43 n HIS 63 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i43 s ALA 64 N -2.08 3.32 0.00 -1.41 0.00 0.19 -1.73 121.76 120.05 1i43 s ALA 64 Ca 0.22 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.09 1i43 s ALA 64 Cb 0.18 -3.88 0.00 0.00 0.00 0.00 0.00 23.12 19.42 1i43 s ALA 64 CO 0.39 -1.91 0.00 0.41 0.00 0.00 0.00 175.76 174.65 1i43 n GLY 65 N 4.77 0.49 2.01 0.00 0.00 -1.26 -3.90 105.19 107.30 1i43 n GLY 65 Ca 0.21 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1i43 n GLY 65 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1i43 n GLU 66 N -2.84 0.00 -0.08 1.61 1.02 -0.71 -4.68 120.64 114.96 1i43 n GLU 66 Ca 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.25 1i43 n GLU 66 Cb 0.00 0.00 0.49 0.00 -0.02 0.00 0.00 31.44 31.91 1i43 n GLU 66 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1i43 h ARG 67 N 0.00 0.42 0.00 3.49 9.65 -1.70 -2.73 114.38 123.51 1i43 h ARG 67 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1i43 h ARG 67 Cb 0.00 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.49 1i43 h ARG 67 CO 0.00 0.28 -0.97 1.28 2.80 0.00 0.00 179.97 183.35 1i43 n LEU 68 N -4.47 0.78 0.00 3.80 4.77 -1.26 -5.05 117.00 115.56 1i43 n LEU 68 Ca 0.09 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 1i43 n LEU 68 Cb 0.34 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1i43 n LEU 68 CO 0.34 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1i43 n GLY 69 N 1.46 3.52 0.00 -0.72 0.00 -1.03 -5.06 105.19 103.36 1i43 n GLY 69 Ca 0.03 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1i43 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i43 n ARG 70 N -1.27 2.60 0.00 1.61 1.74 -1.26 -3.84 116.66 116.24 1i43 n ARG 70 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1i43 n ARG 70 Cb 0.00 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 30.70 1i43 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i43 n GLY 71 N 1.40 3.24 2.76 -0.13 0.00 -1.26 -4.88 105.19 106.32 1i43 n GLY 71 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1i43 n GLY 71 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1i43 n ILE 72 N -1.81 1.21 -1.54 -0.61 0.00 -1.26 -5.09 119.36 110.25 1i43 n ILE 72 Ca 0.00 -4.66 -0.51 0.00 0.00 0.00 0.00 62.75 57.59 1i43 n ILE 72 Cb 0.00 -2.09 -0.05 0.00 0.00 0.00 0.00 39.64 37.50 1i43 n ILE 72 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1i43 n VAL 73 N 1.98 0.82 -3.48 9.51 0.31 -1.26 -4.93 118.33 121.28 1i43 n VAL 73 Ca 0.22 -0.20 -0.11 0.00 -0.01 0.00 0.00 64.34 64.24 1i43 n VAL 73 Cb 0.38 -0.59 -0.02 0.00 -0.91 0.00 0.00 33.84 32.70 1i43 n VAL 73 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1i43 s THR 74 N -0.22 0.00 -0.75 2.52 -4.23 -1.26 -5.01 115.64 106.69 1i43 s THR 74 Ca 0.76 0.00 0.17 0.00 -1.18 0.00 0.00 61.69 61.43 1i43 s THR 74 Cb -0.94 -1.00 0.73 0.00 1.34 0.00 0.00 72.50 72.63 1i43 s THR 74 CO 0.53 0.00 1.65 -0.90 -0.54 0.00 0.00 174.62 175.36 1i43 n ASP 75 N -0.15 4.98 -4.86 3.99 5.75 -1.26 -4.94 116.55 120.06 1i43 n ASP 75 Ca -0.13 -2.65 -0.32 0.00 -0.01 0.00 0.00 54.79 51.69 1i43 n ASP 75 Cb 0.62 -0.60 -0.05 0.00 -1.03 0.00 0.00 41.12 40.06 1i43 n ASP 75 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1i43 s ALA 76 N -2.21 3.41 0.09 2.12 0.00 -1.26 -5.01 121.76 118.91 1i43 s ALA 76 Ca 0.51 -0.13 -0.09 0.00 0.00 0.00 0.00 51.96 52.25 1i43 s ALA 76 Cb 0.35 -2.64 -0.19 0.00 0.00 0.00 0.00 23.12 20.65 1i43 s ALA 76 CO 0.20 0.30 1.22 0.82 0.00 0.00 0.00 175.76 178.30 1i43 h ILE 77 N 1.75 1.36 -2.40 0.00 2.04 -2.02 -3.46 117.51 114.78 1i43 h ILE 77 Ca -0.47 -2.47 -0.44 0.00 1.00 0.00 0.00 64.86 62.48 1i43 h ILE 77 Cb 1.18 2.53 0.05 0.00 -0.74 0.00 0.00 36.82 39.83 1i43 h ILE 77 CO 0.66 0.74 -0.05 0.42 0.00 0.00 0.00 178.15 179.93 1i43 s THR 78 N -3.15 2.66 0.08 -0.27 -4.23 -1.26 -4.99 115.64 104.48 1i43 s THR 78 Ca -0.07 -0.69 -0.27 0.00 -1.18 0.00 0.00 61.69 59.48 1i43 s THR 78 Cb 0.07 -2.97 -0.06 0.00 1.34 0.00 0.00 72.50 70.88 1i43 s THR 78 CO 0.90 0.00 0.84 -0.89 -0.54 0.00 0.00 174.62 174.93 1i43 s THR 79 N -2.75 4.61 0.22 3.99 2.01 -1.26 -5.04 115.64 117.42 1i43 s THR 79 Ca 0.58 1.81 -0.29 0.00 0.31 0.00 0.00 61.69 64.10 1i43 s THR 79 Cb -0.10 -4.20 -0.09 0.00 0.01 0.00 0.00 72.50 68.12 1i43 s THR 79 CO 0.38 0.36 0.90 -2.16 -0.69 0.00 0.00 174.62 173.41 1i43 s PRO 80 N -0.13 4.78 -0.27 4.92 0.05 -1.26 -5.02 135.00 138.08 1i43 s PRO 80 Ca 0.41 1.40 -0.25 0.00 0.05 0.00 0.00 61.00 62.61 1i43 s PRO 80 Cb -0.22 -3.28 -0.00 0.00 0.05 0.00 0.00 34.50 31.06 1i43 s PRO 80 CO 0.26 0.53 0.85 0.08 0.05 0.00 0.00 177.00 178.77 1i43 s VAL 81 N -1.15 4.78 -0.47 -0.36 1.01 -1.26 -4.46 120.40 118.49 1i43 s VAL 81 Ca 0.40 1.49 -0.13 0.00 0.00 0.00 0.00 61.98 63.74 1i43 s VAL 81 Cb -0.25 -4.16 0.09 0.00 0.00 0.00 0.00 36.38 32.06 1i43 s VAL 81 CO 0.30 -0.17 0.36 -0.69 0.00 0.00 0.00 175.10 174.91 1i43 s VAL 82 N 2.97 4.75 -1.19 2.92 1.01 -1.26 -5.00 120.40 124.60 1i43 s VAL 82 Ca 0.36 -1.36 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 1i43 s VAL 82 Cb -0.15 -3.94 0.20 0.00 0.00 0.00 0.00 36.38 32.49 1i43 s VAL 82 CO 0.10 -0.64 1.39 0.59 0.00 0.00 0.00 175.10 176.54 1i43 n ASN 83 N 5.07 5.32 -4.17 3.32 3.02 -1.26 -4.80 115.26 121.76 1i43 n ASN 83 Ca -0.11 -3.01 -0.19 0.00 -0.03 0.00 0.00 54.58 51.24 1i43 n ASN 83 Cb 0.42 -1.51 -0.12 0.00 -0.61 0.00 0.00 39.78 37.96 1i43 n ASN 83 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1i43 s THR 84 N 0.71 1.12 -0.03 3.41 -1.32 -1.26 -5.03 115.64 113.24 1i43 s THR 84 Ca 0.40 -1.30 0.19 0.00 -1.21 0.00 0.00 61.69 59.77 1i43 s THR 84 Cb -0.03 -1.08 -0.29 0.00 -1.51 0.00 0.00 72.50 69.59 1i43 s THR 84 CO -0.01 -0.21 0.39 -1.54 -2.21 0.00 0.00 174.62 171.03 1i43 n SER 85 N 1.30 0.72 -4.06 8.08 3.41 -1.26 -4.73 113.62 117.07 1i43 n SER 85 Ca -0.21 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.30 1i43 n SER 85 Cb 0.54 1.80 -0.08 0.00 -0.26 0.00 0.00 64.21 66.21 1i43 n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i43 s ALA 86 N -3.25 0.35 -0.07 7.33 0.00 -1.26 -1.12 121.76 123.74 1i43 s ALA 86 Ca -0.07 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.72 1i43 s ALA 86 Cb 0.12 1.11 0.02 0.00 0.00 0.00 0.00 23.12 24.36 1i43 s ALA 86 CO 0.78 -0.69 -0.11 0.71 0.00 0.00 0.00 175.76 176.44 1i43 s TYR 87 N -4.05 1.39 0.64 0.00 1.51 -0.70 -4.89 117.35 111.25 1i43 s TYR 87 Ca 0.27 -0.52 -0.05 0.00 -1.01 0.00 0.00 57.07 55.75 1i43 s TYR 87 Cb 0.03 -1.05 0.04 0.00 -0.11 0.00 0.00 41.96 40.88 1i43 s TYR 87 CO 0.07 -0.29 0.94 -0.59 -1.11 0.00 0.00 175.55 174.57 1i43 s PHE 88 N 0.78 3.02 0.03 2.71 -0.12 -1.26 -4.71 117.98 118.43 1i43 s PHE 88 Ca -0.12 0.44 0.05 0.00 -0.05 0.00 0.00 56.93 57.25 1i43 s PHE 88 Cb -0.15 -2.97 -0.02 0.00 -0.63 0.00 0.00 43.02 39.25 1i43 s PHE 88 CO 0.02 -1.13 -0.16 -0.06 -0.05 0.00 0.00 175.22 173.85 1i43 s PHE 89 N -3.09 1.39 0.22 3.49 0.40 -1.26 -5.06 117.98 114.07 1i43 s PHE 89 Ca 0.57 -0.33 -0.06 0.00 -0.60 0.00 0.00 56.93 56.51 1i43 s PHE 89 Cb -0.11 -0.84 0.19 0.00 0.51 0.00 0.00 43.02 42.77 1i43 s PHE 89 CO 0.44 0.03 1.70 -0.91 0.70 0.00 0.00 175.22 177.18 1i43 h ASN 90 N 5.13 0.93 -4.93 1.36 2.35 -1.99 -3.46 115.58 114.97 1i43 h ASN 90 Ca -0.38 -0.25 -0.08 0.00 -0.55 0.00 0.00 56.30 55.05 1i43 h ASN 90 Cb 1.17 -0.25 -0.19 0.00 0.05 0.00 0.00 38.32 39.10 1i43 h ASN 90 CO 0.45 0.98 0.05 -1.59 -1.65 0.00 0.00 177.43 175.67 1i43 s LYS 91 N -5.02 0.93 0.50 0.81 -2.85 -1.26 -5.03 119.74 107.82 1i43 s LYS 91 Ca -0.11 0.17 0.36 0.00 -1.00 0.00 0.00 55.97 55.40 1i43 s LYS 91 Cb 0.14 0.43 1.51 0.00 -2.06 0.00 0.00 37.83 37.85 1i43 s LYS 91 CO 0.84 -0.27 1.68 1.15 0.10 0.00 0.00 175.35 178.85 1i43 h THR 92 N 3.31 0.23 -0.08 3.79 2.02 -2.00 0.32 112.91 120.50 1i43 h THR 92 Ca -0.28 -0.03 0.02 0.00 0.77 0.00 0.00 66.41 66.90 1i43 h THR 92 Cb 1.15 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1i43 h THR 92 CO 0.38 0.01 -0.07 -1.28 0.37 0.00 0.00 175.52 174.93 1i43 h SER 93 N 0.08 -0.23 -0.33 4.18 0.87 -2.00 -1.67 113.55 114.45 1i43 h SER 93 Ca 0.75 0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 61.28 1i43 h SER 93 Cb 2.67 0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 64.73 1i43 h SER 93 CO -0.17 -0.10 -0.05 -0.33 -0.53 0.00 0.00 176.83 175.65 1i43 h GLU 94 N -0.09 0.72 -0.32 2.24 5.08 -0.79 -1.84 114.58 119.57 1i43 h GLU 94 Ca 0.06 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1i43 h GLU 94 Cb 0.17 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1i43 h GLU 94 CO -0.13 0.76 0.12 1.25 -1.00 0.00 0.00 179.01 180.01 1i43 h LEU 95 N 0.67 0.15 -0.38 1.33 5.85 -0.99 0.15 115.31 122.09 1i43 h LEU 95 Ca 0.13 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.88 1i43 h LEU 95 Cb 0.48 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1i43 h LEU 95 CO 0.02 0.12 0.24 0.40 -0.34 0.00 0.00 178.44 178.88 1i43 h ILE 96 N 0.27 1.07 -0.39 4.05 2.04 -1.05 -0.29 117.51 123.21 1i43 h ILE 96 Ca 0.14 -0.17 0.08 0.00 1.00 0.00 0.00 64.86 65.92 1i43 h ILE 96 Cb 0.10 0.55 -0.09 0.00 -0.74 0.00 0.00 36.82 36.64 1i43 h ILE 96 CO -0.13 0.09 -0.21 0.44 0.00 0.00 0.00 178.15 178.33 1i43 h ASP 97 N 0.48 -0.71 -0.77 1.72 3.32 -0.44 0.32 116.42 120.34 1i43 h ASP 97 Ca 0.14 0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 1i43 h ASP 97 Cb -0.03 0.37 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 1i43 h ASP 97 CO -0.05 -0.24 0.46 0.15 -1.72 0.00 0.00 179.24 177.85 1i43 h PHE 98 N -0.14 1.01 0.00 4.55 3.57 -0.51 0.18 116.94 125.60 1i43 h PHE 98 Ca 0.19 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1i43 h PHE 98 Cb 0.44 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.85 1i43 h PHE 98 CO -0.44 0.68 0.00 0.87 -2.23 0.00 0.00 178.31 177.19 1i43 h LYS 99 N 1.05 0.00 -0.61 1.11 1.79 0.73 -2.20 116.57 118.44 1i43 h LYS 99 Ca 0.27 0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 58.48 1i43 h LYS 99 Cb -0.04 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 30.46 1i43 h LYS 99 CO -0.05 0.00 0.21 0.39 -1.08 0.00 0.00 179.45 178.92 1i43 n GLU 100 N -3.05 2.47 -2.19 3.15 1.02 0.94 -4.94 120.64 118.03 1i43 n GLU 100 Ca -0.01 -3.08 -0.14 0.00 -0.02 0.00 0.00 57.16 53.91 1i43 n GLU 100 Cb 0.21 -2.01 -0.02 0.00 -0.02 0.00 0.00 31.44 29.60 1i43 n GLU 100 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1i43 n LYS 101 N -0.87 -1.91 -0.00 3.49 4.01 -0.83 -4.81 118.16 117.24 1i43 n LYS 101 Ca 0.41 0.73 0.09 0.00 -0.51 0.00 0.00 58.31 59.03 1i43 n LYS 101 Cb 1.28 -5.26 -0.13 0.00 -0.51 0.00 0.00 35.03 30.41 1i43 n LYS 101 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1i43 n ARG 102 N -2.64 0.78 -4.33 1.97 1.74 -0.07 -4.98 116.66 109.13 1i43 n ARG 102 Ca -0.16 -0.09 -0.17 0.00 -0.77 0.00 0.00 57.85 56.65 1i43 n ARG 102 Cb 0.59 -1.40 -0.10 0.00 -1.02 0.00 0.00 32.46 30.53 1i43 n ARG 102 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1i43 s ARG 103 N -3.02 1.35 -0.08 5.56 3.52 -1.18 -4.89 118.95 120.20 1i43 s ARG 103 Ca -0.01 -1.68 0.02 0.00 -0.13 0.00 0.00 55.73 53.93 1i43 s ARG 103 Cb 0.13 -0.63 -0.02 0.00 -1.56 0.00 0.00 34.95 32.87 1i43 s ARG 103 CO 0.76 -0.10 -0.13 0.00 -0.81 0.00 0.00 175.30 175.03 1i43 s ALA 104 N -3.41 2.71 -0.20 6.12 0.00 -1.26 -4.56 121.76 121.16 1i43 s ALA 104 Ca 0.29 -0.94 -0.30 0.00 0.00 0.00 0.00 51.96 51.01 1i43 s ALA 104 Cb 0.06 -1.09 0.15 0.00 0.00 0.00 0.00 23.12 22.23 1i43 s ALA 104 CO 0.09 0.46 1.10 0.45 0.00 0.00 0.00 175.76 177.86 1i43 s SER 105 N -0.40 -0.28 0.32 0.00 0.15 -1.26 -5.02 113.70 107.21 1i43 s SER 105 Ca 0.05 0.30 0.22 0.00 0.70 0.00 0.00 55.95 57.22 1i43 s SER 105 Cb -0.12 0.23 0.16 0.00 -1.71 0.00 0.00 66.02 64.58 1i43 s SER 105 CO 0.02 -0.25 1.32 -0.26 1.20 0.00 0.00 173.24 175.27 1i43 h PHE 106 N 2.43 0.00 0.00 3.44 0.04 -1.94 -3.47 116.94 117.44 1i43 h PHE 106 Ca -0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.62 1i43 h PHE 106 Cb 1.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.32 1i43 h PHE 106 CO 0.26 0.04 0.00 -1.91 -0.60 0.00 0.00 178.31 176.10 1i43 n GLU 107 N -2.91 0.00 -4.25 1.51 2.13 -1.26 -4.59 120.64 111.27 1i43 n GLU 107 Ca 0.02 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.62 1i43 n GLU 107 Cb 0.56 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 32.14 1i43 n GLU 107 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1i43 s TYR 108 N 0.00 1.58 -0.60 4.31 5.04 -1.26 -1.73 117.35 124.69 1i43 s TYR 108 Ca 0.00 -0.45 0.14 0.00 -2.44 0.00 0.00 57.07 54.33 1i43 s TYR 108 Cb 0.00 -0.86 0.71 0.00 0.35 0.00 0.00 41.96 42.16 1i43 s TYR 108 CO 0.00 0.16 1.44 0.41 -1.34 0.00 0.00 175.55 176.23 1i43 n GLY 109 N 1.02 -0.85 0.02 8.97 0.00 -0.28 -1.77 105.19 112.30 1i43 n GLY 109 Ca -0.19 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.04 1i43 n GLY 109 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1i43 n ARG 110 N -1.92 0.06 0.00 1.61 0.63 -1.26 -3.58 116.66 112.20 1i43 n ARG 110 Ca 0.00 0.03 0.09 0.00 -0.92 0.00 0.00 57.85 57.05 1i43 n ARG 110 Cb 0.08 -1.55 0.03 0.00 0.45 0.00 0.00 32.46 31.47 1i43 n ARG 110 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1i43 n TYR 111 N -1.64 0.00 0.00 -0.14 4.01 -0.73 -4.71 117.16 113.95 1i43 n TYR 111 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1i43 n TYR 111 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.39 1i43 n TYR 111 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i43 n GLY 112 N 1.19 -0.18 3.64 2.72 0.00 -1.23 -4.98 105.19 106.35 1i43 n GLY 112 Ca 0.09 -1.47 -0.06 0.00 0.00 0.00 0.00 46.02 44.59 1i43 n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i43 s ASN 113 N 0.00 -0.53 0.25 1.61 3.84 -1.26 -4.43 114.94 114.42 1i43 s ASN 113 Ca 0.00 0.92 -0.03 0.00 0.21 0.00 0.00 52.86 53.97 1i43 s ASN 113 Cb 0.00 1.10 0.51 0.00 -0.55 0.00 0.00 41.25 42.31 1i43 s ASN 113 CO 0.00 -0.15 1.72 1.55 -2.79 0.00 0.00 177.10 177.43 1i43 h PRO 114 N 5.35 0.42 0.00 0.43 0.13 -1.96 0.11 132.00 136.48 1i43 h PRO 114 Ca -0.28 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1i43 h PRO 114 Cb 1.19 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1i43 h PRO 114 CO 0.15 0.28 0.00 -2.37 -0.23 0.00 0.00 178.00 175.83 1i43 n THR 115 N -5.02 0.41 -0.02 1.56 5.66 -1.26 -3.48 114.28 112.12 1i43 n THR 115 Ca 0.16 0.01 -0.21 0.00 -3.05 0.00 0.00 64.05 60.96 1i43 n THR 115 Cb 0.46 -0.68 -0.14 0.00 -1.55 0.00 0.00 70.33 68.43 1i43 n THR 115 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1i43 n THR 116 N -1.73 1.73 0.26 1.09 -1.04 0.24 -4.17 114.28 110.65 1i43 n THR 116 Ca 0.06 -0.63 0.09 0.00 -2.04 0.00 0.00 64.05 61.52 1i43 n THR 116 Cb 0.32 -1.68 0.65 0.00 -1.82 0.00 0.00 70.33 67.80 1i43 n THR 116 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 1i43 h VAL 117 N 0.05 0.92 -0.58 12.58 -1.51 -1.23 -1.84 116.25 124.63 1i43 h VAL 117 Ca -0.45 -0.25 0.00 0.00 -1.23 0.00 0.00 66.70 64.77 1i43 h VAL 117 Cb 2.00 1.14 -0.03 0.00 -2.13 0.00 0.00 31.29 32.27 1i43 h VAL 117 CO 0.05 0.07 0.38 0.58 -1.23 0.00 0.00 177.57 177.42 1i43 h VAL 118 N 0.00 1.16 0.00 7.19 2.07 -1.72 0.19 116.25 125.14 1i43 h VAL 118 Ca -0.00 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 1i43 h VAL 118 Cb 0.14 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1i43 h VAL 118 CO 0.01 0.16 -0.49 0.25 0.02 0.00 0.00 177.57 177.52 1i43 h LEU 119 N 0.79 0.00 -0.45 2.57 5.85 -1.54 -0.23 115.31 122.29 1i43 h LEU 119 Ca 0.21 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.85 1i43 h LEU 119 Cb -0.07 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1i43 h LEU 119 CO -0.04 0.49 -0.03 -0.33 -0.34 0.00 0.00 178.44 178.19 1i43 h GLU 120 N 0.00 0.82 -0.17 1.25 5.08 -0.54 -1.96 114.58 119.06 1i43 h GLU 120 Ca -0.00 -0.27 -0.21 0.00 -1.00 0.00 0.00 59.36 57.87 1i43 h GLU 120 Cb 0.87 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.07 1i43 h GLU 120 CO 0.06 0.89 -0.70 0.93 -1.00 0.00 0.00 179.01 179.19 1i43 h GLU 121 N 0.66 0.78 0.52 2.33 5.08 -0.46 -2.36 114.58 121.13 1i43 h GLU 121 Ca 0.13 -0.61 -0.02 0.00 -1.00 0.00 0.00 59.36 57.86 1i43 h GLU 121 Cb 0.54 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1i43 h GLU 121 CO 0.03 1.22 -0.51 -0.22 -1.00 0.00 0.00 179.01 178.54 1i43 h LYS 122 N 0.51 -0.98 -0.45 2.33 3.64 -0.97 0.42 116.57 121.08 1i43 h LYS 122 Ca -0.04 0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1i43 h LYS 122 Cb 1.33 0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 33.35 1i43 h LYS 122 CO 0.15 -0.65 0.30 0.82 -2.27 0.00 0.00 179.45 177.79 1i43 h ILE 123 N -1.02 1.05 -0.69 2.00 2.04 -1.45 -1.54 117.51 117.91 1i43 h ILE 123 Ca -0.07 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.57 1i43 h ILE 123 Cb 0.88 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 1i43 h ILE 123 CO -0.06 0.09 0.22 0.28 0.00 0.00 0.00 178.15 178.69 1i43 h SER 124 N 0.51 1.00 -0.12 1.72 0.02 -0.84 -1.32 113.55 114.51 1i43 h SER 124 Ca 0.18 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1i43 h SER 124 Cb 0.09 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.36 1i43 h SER 124 CO -0.04 0.94 0.02 0.00 -1.14 0.00 0.00 176.83 176.61 1i43 h ALA 125 N 1.10 0.16 -0.06 3.77 0.00 0.02 0.41 119.26 124.67 1i43 h ALA 125 Ca 0.22 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1i43 h ALA 125 Cb 0.29 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1i43 h ALA 125 CO -0.01 -0.18 -0.26 -0.07 0.00 0.00 0.00 179.25 178.73 1i43 h LEU 126 N -0.02 -0.80 0.00 0.00 3.38 -1.14 0.02 115.31 116.75 1i43 h LEU 126 Ca 0.04 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1i43 h LEU 126 Cb 0.29 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1i43 h LEU 126 CO 0.00 -0.32 0.00 -0.62 0.09 0.00 0.00 178.44 177.59 1i43 n GLU 127 N -5.38 0.36 -2.97 1.13 -0.58 -0.52 -4.88 120.64 107.81 1i43 n GLU 127 Ca -0.04 0.04 -0.22 0.00 -0.42 0.00 0.00 57.16 56.52 1i43 n GLU 127 Cb 0.29 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.70 1i43 n GLU 127 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1i43 n GLY 128 N 0.88 -0.52 3.95 0.62 0.00 0.90 -4.77 105.19 106.25 1i43 n GLY 128 Ca 0.12 0.12 -0.24 0.00 0.00 0.00 0.00 46.02 46.03 1i43 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 129 N -3.17 3.51 0.01 4.61 0.00 0.11 -4.99 121.76 121.83 1i43 s ALA 129 Ca 0.28 -1.18 -0.10 0.00 0.00 0.00 0.00 51.96 50.96 1i43 s ALA 129 Cb -0.12 -2.32 -0.31 0.00 0.00 0.00 0.00 23.12 20.36 1i43 s ALA 129 CO 0.35 -1.11 0.90 1.49 0.00 0.00 0.00 175.76 177.39 1i43 h GLU 130 N -0.33 0.39 -2.73 0.00 4.81 -1.76 -3.43 114.58 111.53 1i43 h GLU 130 Ca -0.43 -0.67 -0.06 0.00 -0.13 0.00 0.00 59.36 58.08 1i43 h GLU 130 Cb 1.30 0.25 -0.16 0.00 0.63 0.00 0.00 28.75 30.77 1i43 h GLU 130 CO 0.54 1.30 0.06 0.45 -0.73 0.00 0.00 179.01 180.63 1i43 s SER 131 N -7.29 -0.47 -0.01 1.04 0.15 -0.61 -4.80 113.70 101.71 1i43 s SER 131 Ca -0.10 0.21 0.02 0.00 0.70 0.00 0.00 55.95 56.78 1i43 s SER 131 Cb 0.06 0.50 -0.00 0.00 -1.71 0.00 0.00 66.02 64.87 1i43 s SER 131 CO 0.89 -0.73 -0.06 -0.89 1.20 0.00 0.00 173.24 173.65 1i43 s THR 132 N -2.43 0.48 -0.08 6.45 2.01 -1.26 -1.61 115.64 119.20 1i43 s THR 132 Ca -0.05 -0.25 0.03 0.00 0.31 0.00 0.00 61.69 61.73 1i43 s THR 132 Cb -0.01 -0.42 -0.02 0.00 0.01 0.00 0.00 72.50 72.07 1i43 s THR 132 CO -0.02 0.14 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.68 1i43 s LEU 133 N -0.04 2.58 -0.11 4.42 2.96 0.14 -4.84 118.68 123.79 1i43 s LEU 133 Ca 0.01 -0.31 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 1i43 s LEU 133 Cb -0.04 -1.53 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 1i43 s LEU 133 CO -0.00 0.26 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.39 1i43 s LEU 134 N -0.25 2.68 0.00 -0.68 1.43 -1.26 -1.70 118.68 118.90 1i43 s LEU 134 Ca 0.01 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1i43 s LEU 134 Cb -0.13 -1.58 -0.00 0.00 0.03 0.00 0.00 46.19 44.51 1i43 s LEU 134 CO 0.03 0.22 0.01 0.23 0.23 0.00 0.00 176.35 177.06 1i43 n MET 135 N 3.18 0.91 0.11 1.70 2.81 -0.88 -4.50 117.12 120.45 1i43 n MET 135 Ca -0.18 -3.24 0.03 0.00 -1.81 0.00 0.00 57.70 52.50 1i43 n MET 135 Cb 0.53 0.91 0.43 0.00 -0.71 0.00 0.00 33.22 34.37 1i43 n MET 135 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1i43 h ALA 136 N 1.25 1.61 -3.00 3.04 0.00 -1.13 -1.08 119.26 119.95 1i43 h ALA 136 Ca -0.37 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.46 1i43 h ALA 136 Cb 1.12 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1i43 h ALA 136 CO 0.61 0.29 0.23 -1.54 0.00 0.00 0.00 179.25 178.83 1i43 s SER 137 N -6.86 -0.22 0.17 0.00 1.04 -1.26 -3.02 113.70 103.55 1i43 s SER 137 Ca -0.06 -0.69 -0.13 0.00 0.48 0.00 0.00 55.95 55.55 1i43 s SER 137 Cb 0.16 0.74 0.07 0.00 0.10 0.00 0.00 66.02 67.09 1i43 s SER 137 CO 0.72 -1.39 1.78 1.23 0.98 0.00 0.00 173.24 176.56 1i43 h GLY 138 N 2.01 0.84 0.87 7.32 0.00 -1.76 -2.22 103.07 110.13 1i43 h GLY 138 Ca -0.21 -0.38 0.03 0.00 0.00 0.00 0.00 47.33 46.77 1i43 h GLY 138 CO 0.26 0.37 0.47 -0.33 0.00 0.00 0.00 176.54 177.30 1i43 h MET 139 N 0.76 0.89 -0.91 4.80 2.86 -1.92 -1.12 114.93 120.29 1i43 h MET 139 Ca 0.20 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.80 1i43 h MET 139 Cb 0.05 -0.20 -0.05 0.00 0.06 0.00 0.00 31.60 31.46 1i43 h MET 139 CO -0.03 0.59 0.60 0.00 1.06 0.00 0.00 176.91 179.13 1i43 h ALA 141 N 1.45 -0.85 -0.19 0.00 0.00 -0.63 -0.49 119.26 118.55 1i43 h ALA 141 Ca 0.34 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1i43 h ALA 141 Cb -0.09 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1i43 h ALA 141 CO -0.08 -0.93 0.09 0.77 0.00 0.00 0.00 179.25 179.10 1i43 h SER 142 N -0.94 0.14 0.16 0.00 0.02 -1.16 -0.80 113.55 110.96 1i43 h SER 142 Ca -0.09 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 60.89 1i43 h SER 142 Cb 0.68 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.16 1i43 h SER 142 CO 0.14 0.11 -0.45 0.74 -1.14 0.00 0.00 176.83 176.23 1i43 h THR 143 N 0.20 0.11 -0.36 -2.27 2.02 -0.80 -0.36 112.91 111.46 1i43 h THR 143 Ca 0.08 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.26 1i43 h THR 143 Cb 0.01 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.51 1i43 h THR 143 CO -0.05 0.00 0.22 0.58 0.37 0.00 0.00 175.52 176.64 1i43 h VAL 144 N -0.71 1.06 -0.47 3.16 2.07 -1.00 -1.36 116.25 118.99 1i43 h VAL 144 Ca 0.01 -0.16 0.08 0.00 0.82 0.00 0.00 66.70 67.45 1i43 h VAL 144 Cb 0.72 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 1i43 h VAL 144 CO -0.23 0.08 0.09 -0.03 0.02 0.00 0.00 177.57 177.50 1i43 h MET 145 N 0.45 0.21 0.22 1.57 -1.53 -0.88 0.14 114.93 115.11 1i43 h MET 145 Ca 0.14 -0.01 -0.01 0.00 -3.44 0.00 0.00 59.70 56.37 1i43 h MET 145 Cb -0.03 -0.05 0.00 0.00 -0.55 0.00 0.00 31.60 30.98 1i43 h MET 145 CO -0.05 0.14 -0.11 -0.07 0.14 0.00 0.00 176.91 176.97 1i43 h LEU 146 N 0.22 -0.25 -2.68 3.39 3.38 -0.76 -0.51 115.31 118.10 1i43 h LEU 146 Ca 0.23 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1i43 h LEU 146 Cb 0.31 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1i43 h LEU 146 CO -0.31 -0.05 0.02 -0.07 0.09 0.00 0.00 178.44 178.11 1i43 h LEU 147 N -0.44 0.00 0.04 1.67 3.38 -0.79 -2.05 115.31 117.11 1i43 h LEU 147 Ca -0.03 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.61 1i43 h LEU 147 Cb 0.33 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 1i43 h LEU 147 CO 0.05 0.00 -1.96 0.00 0.09 0.00 0.00 178.44 176.62 1i43 n ALA 148 N -2.20 1.32 -0.07 1.53 0.00 0.44 -4.63 120.51 116.90 1i43 n ALA 148 Ca -0.03 -0.83 -0.16 0.00 0.00 0.00 0.00 53.44 52.42 1i43 n ALA 148 Cb 0.10 -0.64 -0.14 0.00 0.00 0.00 0.00 19.45 18.77 1i43 n ALA 148 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i43 n LEU 149 N -3.14 2.10 -4.66 0.00 4.77 -0.24 -4.87 117.00 110.96 1i43 n LEU 149 Ca -0.26 0.07 -0.41 0.00 -0.03 0.00 0.00 56.01 55.38 1i43 n LEU 149 Cb 1.06 -0.60 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 1i43 n LEU 149 CO 0.43 0.77 0.51 -0.69 -1.33 0.00 0.00 177.39 177.07 1i43 s VAL 150 N -2.54 4.94 0.82 4.08 1.01 -0.79 -5.04 120.40 122.88 1i43 s VAL 150 Ca -0.23 1.43 -0.12 0.00 0.00 0.00 0.00 61.98 63.06 1i43 s VAL 150 Cb 0.08 -4.05 0.09 0.00 0.00 0.00 0.00 36.38 32.50 1i43 s VAL 150 CO 0.72 0.06 1.18 -2.16 0.00 0.00 0.00 175.10 174.90 1i43 s PRO 151 N 2.09 1.80 0.29 2.72 0.05 -1.26 -4.76 135.00 135.92 1i43 s PRO 151 Ca 0.34 -0.02 -0.29 0.00 0.05 0.00 0.00 61.00 61.08 1i43 s PRO 151 Cb -0.16 -1.96 -0.10 0.00 0.05 0.00 0.00 34.50 32.33 1i43 s PRO 151 CO 0.11 -1.67 1.32 0.00 0.05 0.00 0.00 177.00 176.81 1i43 s ALA 152 N -3.58 3.52 0.00 8.56 0.00 -1.26 -2.18 121.76 126.82 1i43 s ALA 152 Ca 0.63 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.82 1i43 s ALA 152 Cb -0.10 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.54 1i43 s ALA 152 CO 0.49 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 176.05 1i43 n GLY 153 N 1.36 2.84 3.42 0.00 0.00 0.55 -4.90 105.19 108.46 1i43 n GLY 153 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1i43 n GLY 153 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i43 s GLY 154 N -1.76 1.48 0.03 -0.02 0.00 -0.93 -4.52 107.32 101.61 1i43 s GLY 154 Ca 0.00 -0.57 0.08 0.00 0.00 0.00 0.00 44.72 44.23 1i43 s GLY 154 CO 0.00 0.30 -0.24 -1.58 0.00 0.00 0.00 173.10 171.58 1i43 s HIS 155 N -2.47 2.12 0.10 1.90 5.65 -1.26 -0.91 115.29 120.43 1i43 s HIS 155 Ca 0.69 -0.40 0.07 0.00 0.25 0.00 0.00 55.06 55.67 1i43 s HIS 155 Cb -0.17 -1.28 -0.03 0.00 -1.18 0.00 0.00 32.58 29.91 1i43 s HIS 155 CO 0.60 0.08 -0.17 -1.50 -0.65 0.00 0.00 174.74 173.11 1i43 s ILE 156 N -0.75 1.42 -0.06 0.89 2.07 0.56 -1.07 121.20 124.26 1i43 s ILE 156 Ca 0.10 -1.55 0.02 0.00 -1.41 0.00 0.00 60.65 57.81 1i43 s ILE 156 Cb -0.09 -1.42 0.01 0.00 0.13 0.00 0.00 42.46 41.08 1i43 s ILE 156 CO 0.01 -0.24 -0.13 -0.69 -1.91 0.00 0.00 174.94 171.99 1i43 s VAL 157 N -1.56 1.19 0.35 4.00 1.01 -0.82 0.41 120.40 124.98 1i43 s VAL 157 Ca 0.05 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1i43 s VAL 157 Cb -0.08 -1.07 -0.01 0.00 0.00 0.00 0.00 36.38 35.22 1i43 s VAL 157 CO 0.03 0.36 0.41 0.42 0.00 0.00 0.00 175.10 176.33 1i43 s THR 158 N 0.59 0.00 0.42 3.92 -4.23 -0.57 -0.21 115.64 115.57 1i43 s THR 158 Ca -0.14 -1.75 0.03 0.00 -1.18 0.00 0.00 61.69 58.65 1i43 s THR 158 Cb -0.15 -2.62 -0.00 0.00 1.34 0.00 0.00 72.50 71.07 1i43 s THR 158 CO 0.04 0.00 0.60 0.42 -0.54 0.00 0.00 174.62 175.14 1i43 s THR 159 N -3.10 3.84 -0.33 3.99 -4.23 -1.26 -0.70 115.64 113.85 1i43 s THR 159 Ca 0.35 -0.72 0.27 0.00 -1.18 0.00 0.00 61.69 60.41 1i43 s THR 159 Cb 0.00 -3.38 0.34 0.00 1.34 0.00 0.00 72.50 70.80 1i43 s THR 159 CO 0.24 -0.22 1.77 0.71 -0.54 0.00 0.00 174.62 176.58 1i43 h THR 160 N 0.55 0.00 -0.43 3.99 1.35 -0.97 -3.10 112.91 114.31 1i43 h THR 160 Ca -0.45 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 1i43 h THR 160 Cb 1.26 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.31 1i43 h THR 160 CO 0.54 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 176.28 1i43 n ASP 161 N -2.84 2.87 -4.59 5.36 9.92 -1.26 -4.97 116.55 121.03 1i43 n ASP 161 Ca 0.03 -2.16 -0.40 0.00 -0.53 0.00 0.00 54.79 51.73 1i43 n ASP 161 Cb 0.41 -0.39 0.03 0.00 -0.64 0.00 0.00 41.12 40.52 1i43 n ASP 161 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1i43 n TYR 163 N -1.08 2.22 -0.16 0.00 9.36 -1.26 -4.76 117.16 121.48 1i43 n TYR 163 Ca 0.11 0.30 -0.07 0.00 3.32 0.00 0.00 57.90 61.57 1i43 n TYR 163 Cb 0.43 -2.52 -0.06 0.00 -0.63 0.00 0.00 39.34 36.56 1i43 n TYR 163 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 1i43 h ARG 164 N 5.69 -0.10 -0.90 2.98 2.43 -1.94 0.10 114.38 122.65 1i43 h ARG 164 Ca -0.45 0.01 0.19 0.00 -0.81 0.00 0.00 59.98 58.91 1i43 h ARG 164 Cb 1.26 0.02 -0.11 0.00 -0.42 0.00 0.00 29.97 30.72 1i43 h ARG 164 CO 0.87 -0.07 0.45 0.87 -1.51 0.00 0.00 179.97 180.58 1i43 h LYS 165 N -0.11 0.53 -0.26 0.20 6.56 -1.99 0.27 116.57 121.78 1i43 h LYS 165 Ca 0.07 -0.03 -0.08 0.00 -1.06 0.00 0.00 60.65 59.55 1i43 h LYS 165 Cb 0.28 -0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 31.80 1i43 h LYS 165 CO -0.43 0.35 -0.17 1.15 -2.06 0.00 0.00 179.45 178.29 1i43 h THR 166 N 0.55 1.24 -0.09 -0.16 2.02 -1.64 -2.04 112.91 112.80 1i43 h THR 166 Ca 0.53 -1.09 -0.00 0.00 0.77 0.00 0.00 66.41 66.62 1i43 h THR 166 Cb 0.89 1.23 -0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1i43 h THR 166 CO -0.44 0.35 0.04 -0.09 0.37 0.00 0.00 175.52 175.76 1i43 h ARG 167 N 0.41 0.13 -0.73 6.66 9.65 0.14 -2.34 114.38 128.30 1i43 h ARG 167 Ca 0.07 -0.02 0.08 0.00 -1.10 0.00 0.00 59.98 59.01 1i43 h ARG 167 Cb 0.54 -0.02 -0.07 0.00 -1.39 0.00 0.00 29.97 29.03 1i43 h ARG 167 CO 0.04 0.20 0.40 0.82 2.80 0.00 0.00 179.97 184.22 1i43 h ILE 168 N 0.03 0.91 -0.77 1.20 2.04 -0.81 -0.17 117.51 119.94 1i43 h ILE 168 Ca 0.03 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1i43 h ILE 168 Cb 0.11 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.31 1i43 h ILE 168 CO -0.00 0.13 0.40 0.15 0.00 0.00 0.00 178.15 178.82 1i43 h PHE 169 N 0.69 1.07 0.00 1.37 3.57 -1.16 -0.74 116.94 121.74 1i43 h PHE 169 Ca 0.35 -0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.68 1i43 h PHE 169 Cb 0.30 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1i43 h PHE 169 CO -0.08 0.76 -0.62 0.82 -2.23 0.00 0.00 178.31 176.96 1i43 h ILE 170 N 1.09 1.12 -0.01 1.41 2.04 -0.82 -1.79 117.51 120.54 1i43 h ILE 170 Ca 0.27 -2.43 0.00 0.00 1.00 0.00 0.00 64.86 63.70 1i43 h ILE 170 Cb 0.07 2.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 1i43 h ILE 170 CO -0.04 0.61 -0.43 -0.62 0.00 0.00 0.00 178.15 177.66 1i43 n GLU 171 N -3.33 1.02 0.00 2.37 1.02 -0.14 -4.30 120.64 117.28 1i43 n GLU 171 Ca 0.01 -0.78 0.00 0.00 -0.02 0.00 0.00 57.16 56.37 1i43 n GLU 171 Cb 0.75 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 1i43 n GLU 171 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1i43 n THR 172 N -0.31 0.00 -0.14 2.62 -2.24 -0.31 -4.85 114.28 109.06 1i43 n THR 172 Ca 0.10 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.59 1i43 n THR 172 Cb 0.42 -0.46 -0.10 0.00 -2.10 0.00 0.00 70.33 68.10 1i43 n THR 172 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1i43 n ILE 173 N -1.28 1.53 -0.34 2.28 2.08 -0.71 -4.55 119.36 118.37 1i43 n ILE 173 Ca 0.00 -0.35 0.06 0.00 0.56 0.00 0.00 62.75 63.02 1i43 n ILE 173 Cb 0.24 -1.91 0.24 0.00 -0.75 0.00 0.00 39.64 37.46 1i43 n ILE 173 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1i43 h LEU 174 N -1.00 0.92 -2.32 1.39 3.38 -1.66 -1.22 115.31 114.80 1i43 h LEU 174 Ca -0.66 0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.38 1i43 h LEU 174 Cb 1.57 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 1i43 h LEU 174 CO -0.40 0.53 0.18 1.55 0.09 0.00 0.00 178.44 180.40 1i43 h PRO 175 N 1.01 0.00 0.00 1.13 0.13 -1.74 0.94 132.00 133.47 1i43 h PRO 175 Ca 0.45 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.56 1i43 h PRO 175 Cb 0.37 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.50 1i43 h PRO 175 CO -0.21 0.00 -0.12 0.87 -0.23 0.00 0.00 178.00 178.31 1i43 h LYS 176 N 0.00 0.00 -0.64 0.86 1.57 -1.46 0.30 116.57 117.20 1i43 h LYS 176 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1i43 h LYS 176 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1i43 h LYS 176 CO -0.00 0.12 0.00 -1.33 -0.57 0.00 0.00 179.45 177.67 1i43 n MET 177 N -4.18 3.15 -1.02 3.15 0.00 0.26 -4.90 117.12 113.59 1i43 n MET 177 Ca -0.02 -2.46 -0.01 0.00 0.00 0.00 0.00 57.70 55.21 1i43 n MET 177 Cb 0.20 -1.73 -0.00 0.00 0.00 0.00 0.00 33.22 31.69 1i43 n MET 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1i43 n GLY 178 N 1.18 0.47 3.66 3.03 0.00 0.10 -0.33 105.19 113.30 1i43 n GLY 178 Ca 0.22 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1i43 n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i43 s ILE 179 N -1.89 4.52 0.10 -0.61 1.01 -0.84 -3.14 121.20 120.36 1i43 s ILE 179 Ca 0.00 1.83 0.02 0.00 0.00 0.00 0.00 60.65 62.51 1i43 s ILE 179 Cb 0.00 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 1i43 s ILE 179 CO 0.00 -0.15 0.18 0.28 0.00 0.00 0.00 174.94 175.24 1i43 s THR 180 N 3.25 4.97 0.10 2.92 -1.32 -0.08 -3.48 115.64 122.00 1i43 s THR 180 Ca 0.49 -0.69 0.03 0.00 -1.21 0.00 0.00 61.69 60.31 1i43 s THR 180 Cb -0.18 -3.47 -0.04 0.00 -1.51 0.00 0.00 72.50 67.31 1i43 s THR 180 CO 0.10 0.04 -0.09 0.00 -2.21 0.00 0.00 174.62 172.46 1i43 s ALA 181 N -1.57 1.12 -0.15 11.08 0.00 -1.26 -0.32 121.76 130.66 1i43 s ALA 181 Ca 0.33 -1.25 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1i43 s ALA 181 Cb -0.12 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.08 1i43 s ALA 181 CO 0.26 -0.08 -0.18 0.99 0.00 0.00 0.00 175.76 176.75 1i43 s THR 182 N -2.76 1.81 -0.31 0.00 2.01 0.17 -4.91 115.64 111.66 1i43 s THR 182 Ca 0.08 -0.80 -0.10 0.00 0.31 0.00 0.00 61.69 61.18 1i43 s THR 182 Cb -0.01 -1.65 -0.01 0.00 0.01 0.00 0.00 72.50 70.84 1i43 s THR 182 CO -0.01 0.50 0.16 -0.69 -0.69 0.00 0.00 174.62 173.90 1i43 s VAL 183 N 1.19 4.74 0.41 3.82 1.01 -1.26 -1.51 120.40 128.81 1i43 s VAL 183 Ca 0.00 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 61.74 1i43 s VAL 183 Cb -0.14 -3.39 -0.07 0.00 0.00 0.00 0.00 36.38 32.78 1i43 s VAL 183 CO -0.08 0.09 0.10 0.27 0.00 0.00 0.00 175.10 175.48 1i43 s ILE 184 N 1.64 2.17 0.33 2.22 -4.36 0.13 -4.86 121.20 118.47 1i43 s ILE 184 Ca 0.05 -1.85 -0.26 0.00 -0.26 0.00 0.00 60.65 58.33 1i43 s ILE 184 Cb -0.17 -2.99 -0.10 0.00 1.25 0.00 0.00 42.46 40.45 1i43 s ILE 184 CO 0.07 -0.00 0.95 -0.62 0.24 0.00 0.00 174.94 175.58 1i43 s ASP 185 N -3.81 7.31 0.31 4.36 2.15 -1.26 -0.27 116.67 125.46 1i43 s ASP 185 Ca 0.38 1.85 0.08 0.00 0.43 0.00 0.00 52.55 55.29 1i43 s ASP 185 Cb 0.07 -2.58 0.82 0.00 -0.30 0.00 0.00 42.92 40.93 1i43 s ASP 185 CO 0.20 -0.09 1.75 -0.65 -0.17 0.00 0.00 175.17 176.21 1i43 h PRO 186 N 3.15 0.64 0.02 4.34 0.11 -1.94 -2.41 132.00 135.91 1i43 h PRO 186 Ca -0.47 -0.04 -0.27 0.00 0.11 0.00 0.00 66.00 65.33 1i43 h PRO 186 Cb 1.19 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 1i43 h PRO 186 CO 0.65 0.42 -1.50 0.00 -0.21 0.00 0.00 178.00 177.36 1i43 h ALA 187 N 1.69 0.60 -0.58 -0.75 0.00 -1.93 -3.45 119.26 114.85 1i43 h ALA 187 Ca 0.62 -1.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.13 1i43 h ALA 187 Cb 1.08 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1i43 h ALA 187 CO -0.44 1.44 0.48 -3.47 0.00 0.00 0.00 179.25 177.26 1i43 n ASP 188 N -3.19 1.72 0.06 0.00 -0.08 -0.91 -4.72 116.55 109.43 1i43 n ASP 188 Ca -0.13 -1.22 -0.07 0.00 -1.51 0.00 0.00 54.79 51.87 1i43 n ASP 188 Cb 1.02 -1.58 -0.11 0.00 2.34 0.00 0.00 41.12 42.79 1i43 n ASP 188 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1i43 h VAL 189 N 7.67 1.64 -0.17 5.18 2.07 -1.86 -3.24 116.25 127.54 1i43 h VAL 189 Ca -0.05 -3.33 -0.01 0.00 0.82 0.00 0.00 66.70 64.13 1i43 h VAL 189 Cb 1.07 2.81 -0.01 0.00 -1.52 0.00 0.00 31.29 33.64 1i43 h VAL 189 CO 1.07 0.93 0.09 1.23 0.02 0.00 0.00 177.57 180.91 1i43 h GLY 190 N 3.05 0.26 0.25 2.17 0.00 -1.98 -0.98 103.07 105.83 1i43 h GLY 190 Ca -0.02 -0.12 0.14 0.00 0.00 0.00 0.00 47.33 47.32 1i43 h GLY 190 CO 0.12 0.12 0.38 0.00 0.00 0.00 0.00 176.54 177.16 1i43 h ALA 191 N 0.96 1.16 -0.18 3.60 0.00 -1.96 0.32 119.26 123.17 1i43 h ALA 191 Ca 0.06 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1i43 h ALA 191 Cb 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1i43 h ALA 191 CO -0.01 -0.12 0.07 1.25 0.00 0.00 0.00 179.25 180.44 1i43 h LEU 192 N 0.57 0.25 -1.09 0.00 5.85 -1.49 -0.65 115.31 118.75 1i43 h LEU 192 Ca 0.43 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 1i43 h LEU 192 Cb 0.59 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 1i43 h LEU 192 CO -0.36 0.36 0.47 -0.08 -0.34 0.00 0.00 178.44 178.49 1i43 h GLU 193 N 0.13 1.10 0.65 1.25 4.81 0.20 0.99 114.58 123.71 1i43 h GLU 193 Ca 0.06 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1i43 h GLU 193 Cb 0.19 -0.23 0.01 0.00 0.63 0.00 0.00 28.75 29.35 1i43 h GLU 193 CO -0.00 0.78 -0.31 1.25 -0.73 0.00 0.00 179.01 179.99 1i43 h LEU 194 N 1.11 -0.74 -1.43 1.64 5.85 -0.16 -2.76 115.31 118.83 1i43 h LEU 194 Ca 0.29 0.03 0.22 0.00 0.84 0.00 0.00 57.88 59.25 1i43 h LEU 194 Cb -0.03 0.19 -0.08 0.00 0.37 0.00 0.00 40.66 41.12 1i43 h LEU 194 CO -0.05 -0.47 0.62 0.00 -0.34 0.00 0.00 178.44 178.20 1i43 h ALA 195 N -1.47 2.17 0.00 1.25 0.00 -1.02 0.67 119.26 120.86 1i43 h ALA 195 Ca -0.09 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1i43 h ALA 195 Cb 0.67 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1i43 h ALA 195 CO 0.15 -0.49 -0.00 -0.07 0.00 0.00 0.00 179.25 178.83 1i43 h LEU 196 N 0.44 0.00 0.00 0.00 -0.00 -0.55 -2.99 115.31 112.22 1i43 h LEU 196 Ca 0.51 0.00 -0.35 0.00 -0.00 0.00 0.00 57.88 58.05 1i43 h LEU 196 Cb 1.24 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.84 1i43 h LEU 196 CO -0.22 0.00 -2.26 0.59 -0.00 0.00 0.00 178.44 176.54 1i43 n ASN 197 N -3.38 2.13 0.00 -0.43 3.02 0.22 -4.65 115.26 112.17 1i43 n ASN 197 Ca -0.03 -0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 1i43 n ASN 197 Cb 0.08 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 1i43 n ASN 197 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i43 n GLN 198 N -3.38 0.00 -2.81 3.52 6.02 -0.31 -4.79 117.38 115.64 1i43 n GLN 198 Ca -0.41 0.37 -0.21 0.00 -0.01 0.00 0.00 57.00 56.74 1i43 n GLN 198 Cb 0.89 -1.32 0.03 0.00 1.02 0.00 0.00 30.24 30.85 1i43 n GLN 198 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1i43 s LYS 199 N -2.30 2.75 -0.63 -1.09 3.01 -1.14 -5.04 119.74 115.31 1i43 s LYS 199 Ca 0.00 -0.72 -0.20 0.00 -1.01 0.00 0.00 55.97 54.03 1i43 s LYS 199 Cb 0.00 -2.54 0.09 0.00 -1.01 0.00 0.00 37.83 34.37 1i43 s LYS 199 CO 0.00 -0.51 0.81 0.21 0.51 0.00 0.00 175.35 176.36 1i43 s LYS 200 N -4.65 3.08 0.16 1.68 2.20 -1.26 -4.56 119.74 116.40 1i43 s LYS 200 Ca 0.54 -1.17 -0.31 0.00 -0.36 0.00 0.00 55.97 54.67 1i43 s LYS 200 Cb -0.10 -4.27 -0.08 0.00 -1.51 0.00 0.00 37.83 31.87 1i43 s LYS 200 CO 0.38 -1.65 1.33 0.08 -0.36 0.00 0.00 175.35 175.13 1i43 s VAL 201 N 3.15 3.31 -0.15 4.02 1.01 -1.26 -4.27 120.40 126.20 1i43 s VAL 201 Ca 0.16 1.01 -0.09 0.00 0.00 0.00 0.00 61.98 63.06 1i43 s VAL 201 Cb -0.21 -3.65 -0.24 0.00 0.00 0.00 0.00 36.38 32.29 1i43 s VAL 201 CO 0.07 0.12 0.27 0.59 0.00 0.00 0.00 175.10 176.15 1i43 n ASN 202 N 3.20 2.06 -3.63 3.32 4.13 -0.24 -4.16 115.26 119.94 1i43 n ASN 202 Ca 0.08 0.23 -0.12 0.00 1.68 0.00 0.00 54.58 56.45 1i43 n ASN 202 Cb 0.43 -0.85 -0.07 0.00 -1.54 0.00 0.00 39.78 37.75 1i43 n ASN 202 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1i43 s LEU 203 N -7.17 -0.75 -0.33 3.41 0.20 -1.24 -1.92 118.68 110.87 1i43 s LEU 203 Ca -0.25 1.40 -0.11 0.00 0.69 0.00 0.00 54.13 55.86 1i43 s LEU 203 Cb 0.07 2.39 -0.01 0.00 -0.43 0.00 0.00 46.19 48.21 1i43 s LEU 203 CO 0.71 -0.24 0.20 0.12 -0.29 0.00 0.00 176.35 176.86 1i43 s PHE 204 N 0.60 3.21 -0.06 5.38 5.36 0.42 -1.95 117.98 130.93 1i43 s PHE 204 Ca -0.02 -0.42 0.03 0.00 -0.96 0.00 0.00 56.93 55.56 1i43 s PHE 204 Cb -0.05 -2.42 -0.02 0.00 -0.34 0.00 0.00 43.02 40.19 1i43 s PHE 204 CO -0.04 -0.42 -0.14 0.12 -1.46 0.00 0.00 175.22 173.28 1i43 s PHE 205 N 1.66 2.71 -0.12 10.12 5.36 0.71 -1.05 117.98 137.37 1i43 s PHE 205 Ca 0.05 -0.26 -0.33 0.00 -0.96 0.00 0.00 56.93 55.43 1i43 s PHE 205 Cb -0.17 -1.67 0.12 0.00 -0.34 0.00 0.00 43.02 40.97 1i43 s PHE 205 CO 0.08 0.10 1.10 -0.08 -1.46 0.00 0.00 175.22 174.97 1i43 s THR 206 N -0.52 0.00 0.13 0.12 -1.32 -0.90 -4.01 115.64 109.14 1i43 s THR 206 Ca 0.07 -0.02 0.06 0.00 -1.21 0.00 0.00 61.69 60.59 1i43 s THR 206 Cb -0.12 -1.06 -0.04 0.00 -1.51 0.00 0.00 72.50 69.77 1i43 s THR 206 CO 0.01 0.00 -0.02 -1.83 -2.21 0.00 0.00 174.62 170.58 1i43 s GLU 207 N -2.66 2.41 -0.28 7.08 -1.05 -1.26 -0.83 118.70 122.10 1i43 s GLU 207 Ca 0.08 -0.99 -0.05 0.00 -0.15 0.00 0.00 54.97 53.86 1i43 s GLU 207 Cb -0.01 -2.42 0.15 0.00 -0.44 0.00 0.00 34.13 31.42 1i43 s GLU 207 CO -0.06 0.50 0.57 0.45 0.95 0.00 0.00 175.26 177.66 1i43 s SER 208 N -2.59 -0.96 0.92 0.83 0.15 -1.15 -4.01 113.70 106.89 1i43 s SER 208 Ca 0.26 1.05 -0.10 0.00 0.70 0.00 0.00 55.95 57.86 1i43 s SER 208 Cb -0.10 1.98 0.15 0.00 -1.71 0.00 0.00 66.02 66.34 1i43 s SER 208 CO 0.18 -0.25 1.14 -2.84 1.20 0.00 0.00 173.24 172.67 1i43 s PRO 209 N 2.80 0.94 0.56 5.44 0.02 -1.26 -4.53 135.00 138.98 1i43 s PRO 209 Ca 0.08 1.54 -0.00 0.00 0.02 0.00 0.00 61.00 62.63 1i43 s PRO 209 Cb -0.14 -1.72 0.03 0.00 0.02 0.00 0.00 34.50 32.70 1i43 s PRO 209 CO -0.19 -2.68 0.80 -0.08 -0.33 0.00 0.00 177.00 174.52 1i43 s THR 210 N -2.64 2.80 -0.07 0.99 -1.32 0.21 -4.68 115.64 110.93 1i43 s THR 210 Ca 0.67 -0.57 0.05 0.00 -1.21 0.00 0.00 61.69 60.63 1i43 s THR 210 Cb -0.23 -3.07 -0.01 0.00 -1.51 0.00 0.00 72.50 67.68 1i43 s THR 210 CO 0.58 -0.05 -0.23 0.21 -2.21 0.00 0.00 174.62 172.91 1i43 s ASN 211 N -4.41 3.19 0.00 8.08 2.47 -1.26 -0.83 114.94 122.18 1i43 s ASN 211 Ca 0.57 -0.49 0.22 0.00 0.42 0.00 0.00 52.86 53.57 1i43 s ASN 211 Cb -0.10 -1.02 0.33 0.00 -1.45 0.00 0.00 41.25 39.01 1i43 s ASN 211 CO 0.39 0.23 1.31 -0.81 -3.72 0.00 0.00 177.10 174.50 1i43 n PRO 212 N 3.08 2.31 -0.25 0.43 -0.04 -1.26 -4.74 135.00 134.54 1i43 n PRO 212 Ca -0.18 -2.09 0.05 0.00 -0.04 0.00 0.00 63.50 61.24 1i43 n PRO 212 Cb 0.52 -1.46 0.17 0.00 -0.04 0.00 0.00 33.50 32.69 1i43 n PRO 212 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1i43 n PHE 213 N 1.34 0.61 -4.37 0.54 3.72 -1.26 -4.63 117.46 113.42 1i43 n PHE 213 Ca 0.16 -0.27 -0.35 0.00 -0.05 0.00 0.00 57.45 56.95 1i43 n PHE 213 Cb 0.57 -0.07 -0.08 0.00 -0.94 0.00 0.00 39.48 38.95 1i43 n PHE 213 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1i43 n LEU 214 N 0.50 -1.03 -4.74 4.37 4.77 -0.01 -4.78 117.00 116.07 1i43 n LEU 214 Ca 0.12 -1.24 -0.41 0.00 -0.03 0.00 0.00 56.01 54.46 1i43 n LEU 214 Cb 0.40 -1.66 -0.05 0.00 -2.33 0.00 0.00 43.42 39.79 1i43 n LEU 214 CO 0.10 0.33 0.75 -0.13 -1.33 0.00 0.00 177.39 177.11 1i43 s ARG 215 N -7.27 4.67 0.14 3.23 1.81 -1.26 -4.30 118.95 115.98 1i43 s ARG 215 Ca 0.33 1.65 0.05 0.00 -1.72 0.00 0.00 55.73 56.04 1i43 s ARG 215 Cb -0.19 -3.27 -0.04 0.00 -0.45 0.00 0.00 34.95 31.00 1i43 s ARG 215 CO 1.00 0.22 0.08 0.00 -0.68 0.00 0.00 175.30 175.91 1i43 s VAL 217 N -1.63 2.06 -0.98 0.00 1.01 -1.26 -4.75 120.40 114.85 1i43 s VAL 217 Ca 0.29 -1.06 -0.24 0.00 0.00 0.00 0.00 61.98 60.97 1i43 s VAL 217 Cb -0.10 -1.75 -0.08 0.00 0.00 0.00 0.00 36.38 34.45 1i43 s VAL 217 CO 0.21 0.57 1.99 -0.62 0.00 0.00 0.00 175.10 177.25 1i43 s ASP 218 N -0.04 4.92 0.18 3.32 -1.08 -1.26 -4.79 116.67 117.92 1i43 s ASP 218 Ca -0.07 -0.90 -0.16 0.00 -0.52 0.00 0.00 52.55 50.89 1i43 s ASP 218 Cb -0.15 -2.57 0.14 0.00 -1.46 0.00 0.00 42.92 38.89 1i43 s ASP 218 CO 0.05 -3.04 1.65 0.40 0.52 0.00 0.00 175.17 174.75 1i43 h ILE 219 N 6.97 0.47 -0.10 4.11 2.04 -1.96 0.45 117.51 129.49 1i43 h ILE 219 Ca 0.12 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.02 1i43 h ILE 219 Cb 0.99 0.47 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 1i43 h ILE 219 CO 1.19 0.00 -0.27 -0.08 0.00 0.00 0.00 178.15 178.98 1i43 h GLU 220 N -0.03 -0.35 0.35 2.37 4.81 -1.85 0.00 114.58 119.89 1i43 h GLU 220 Ca 0.23 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.47 1i43 h GLU 220 Cb 0.38 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1i43 h GLU 220 CO -0.51 -0.23 -0.17 1.25 -0.73 0.00 0.00 179.01 178.62 1i43 h LEU 221 N -0.36 -0.40 -0.99 1.64 5.85 -1.73 -2.54 115.31 116.78 1i43 h LEU 221 Ca 0.09 0.01 0.27 0.00 0.84 0.00 0.00 57.88 59.10 1i43 h LEU 221 Cb 0.50 0.10 -0.18 0.00 0.37 0.00 0.00 40.66 41.44 1i43 h LEU 221 CO -0.30 -0.29 0.03 0.58 -0.34 0.00 0.00 178.44 178.12 1i43 h VAL 222 N -0.47 0.02 -0.03 1.05 2.07 -0.88 0.27 116.25 118.27 1i43 h VAL 222 Ca -0.05 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.48 1i43 h VAL 222 Cb 0.36 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1i43 h VAL 222 CO 0.08 0.00 -0.04 0.28 0.02 0.00 0.00 177.57 177.91 1i43 h SER 223 N 0.01 -0.13 -0.45 0.57 0.02 -0.95 -2.09 113.55 110.53 1i43 h SER 223 Ca 0.60 0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.66 1i43 h SER 223 Cb 1.24 0.06 -0.07 0.00 0.14 0.00 0.00 62.40 63.77 1i43 h SER 223 CO -0.93 -0.07 -0.01 0.50 -1.14 0.00 0.00 176.83 175.18 1i43 h LYS 224 N -0.07 0.09 -0.24 3.45 3.64 -0.04 0.68 116.57 124.08 1i43 h LYS 224 Ca 0.03 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1i43 h LYS 224 Cb 0.11 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1i43 h LYS 224 CO -0.07 0.06 0.16 -0.07 -2.27 0.00 0.00 179.45 177.26 1i43 h LEU 225 N 0.09 0.27 0.95 5.20 3.38 -1.25 -2.16 115.31 121.80 1i43 h LEU 225 Ca 0.22 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 1i43 h LEU 225 Cb 0.33 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1i43 h LEU 225 CO -0.38 0.20 -0.46 0.00 0.09 0.00 0.00 178.44 177.89 1i43 h HIS 227 N -1.30 0.00 -0.11 0.00 3.86 -0.89 0.36 115.15 117.07 1i43 h HIS 227 Ca -0.13 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.00 1i43 h HIS 227 Cb 0.98 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.44 1i43 h HIS 227 CO -0.00 0.00 -0.30 1.49 0.86 0.00 0.00 177.93 179.97 1i43 h GLU 228 N 0.00 0.21 -0.43 2.45 4.81 -1.05 -2.83 114.58 117.75 1i43 h GLU 228 Ca 0.13 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1i43 h GLU 228 Cb 0.82 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1i43 h GLU 228 CO -0.00 0.50 0.00 1.63 -0.73 0.00 0.00 179.01 180.41 1i43 n LYS 229 N -4.12 3.19 -0.99 1.92 4.76 0.12 -4.96 118.16 118.08 1i43 n LYS 229 Ca -0.01 -2.58 0.00 0.00 -2.87 0.00 0.00 58.31 52.85 1i43 n LYS 229 Cb 0.39 -1.66 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 1i43 n LYS 229 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i43 n GLY 230 N 0.45 0.51 3.84 0.72 0.00 -0.64 -4.85 105.19 105.22 1i43 n GLY 230 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1i43 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 231 N -2.17 2.97 0.16 4.61 0.00 -0.56 -4.91 121.76 121.85 1i43 s ALA 231 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 51.96 52.12 1i43 s ALA 231 Cb 0.00 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 1i43 s ALA 231 CO 0.00 -0.60 0.24 -0.51 0.00 0.00 0.00 175.76 174.89 1i43 s LEU 232 N -4.65 4.17 -0.12 0.00 1.43 -0.81 -3.75 118.68 114.95 1i43 s LEU 232 Ca 0.59 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 1i43 s LEU 232 Cb -0.12 -2.75 0.02 0.00 0.03 0.00 0.00 46.19 43.37 1i43 s LEU 232 CO 0.42 0.05 -0.14 -0.69 0.23 0.00 0.00 176.35 176.23 1i43 s VAL 233 N -1.75 1.42 -0.07 -1.59 1.01 -1.26 0.16 120.40 118.32 1i43 s VAL 233 Ca 0.33 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.79 1i43 s VAL 233 Cb -0.11 -1.32 -0.00 0.00 0.00 0.00 0.00 36.38 34.95 1i43 s VAL 233 CO 0.27 0.43 -0.21 0.00 0.00 0.00 0.00 175.10 175.59 1i43 s ILE 235 N 0.13 2.09 -0.86 0.00 -1.09 -0.45 -2.12 121.20 118.89 1i43 s ILE 235 Ca -0.09 -1.04 -0.14 0.00 -2.23 0.00 0.00 60.65 57.15 1i43 s ILE 235 Cb -0.15 -1.77 0.22 0.00 -1.58 0.00 0.00 42.46 39.18 1i43 s ILE 235 CO 0.05 0.57 0.83 -0.62 -1.23 0.00 0.00 174.94 174.53 1i43 s ASP 236 N 0.00 6.80 -0.09 3.58 2.15 -0.01 -1.30 116.67 127.80 1i43 s ASP 236 Ca -0.09 -2.72 0.00 0.00 0.43 0.00 0.00 52.55 50.18 1i43 s ASP 236 Cb -0.15 -2.23 0.11 0.00 -0.30 0.00 0.00 42.92 40.35 1i43 s ASP 236 CO 0.05 -0.59 1.45 0.61 -0.17 0.00 0.00 175.17 176.52 1i43 n GLY 237 N 3.98 2.66 0.39 2.66 0.00 -0.97 -2.92 105.19 110.99 1i43 n GLY 237 Ca 0.16 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 1i43 n GLY 237 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1i43 h THR 238 N 0.45 0.22 -0.29 2.61 2.02 -1.88 0.19 112.91 116.23 1i43 h THR 238 Ca 0.11 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.25 1i43 h THR 238 Cb 1.21 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 1i43 h THR 238 CO 0.23 0.00 -0.02 -0.26 0.37 0.00 0.00 175.52 175.83 1i43 h PHE 239 N -0.62 0.46 0.26 3.16 0.04 -1.83 -3.28 116.94 115.12 1i43 h PHE 239 Ca 0.02 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 1i43 h PHE 239 Cb 0.65 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.67 1i43 h PHE 239 CO -0.33 0.48 -0.12 0.00 -0.60 0.00 0.00 178.31 177.73 1i43 h ALA 240 N 1.56 -0.35 0.00 2.45 0.00 -1.65 -3.41 119.26 117.85 1i43 h ALA 240 Ca 0.09 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1i43 h ALA 240 Cb 0.32 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1i43 h ALA 240 CO 0.01 -0.39 0.00 2.41 0.00 0.00 0.00 179.25 181.28 1i43 n THR 241 N -5.01 -0.47 0.19 0.00 -1.04 0.63 -3.83 114.28 104.74 1i43 n THR 241 Ca -0.07 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 61.95 1i43 n THR 241 Cb 0.24 0.00 0.08 0.00 -1.82 0.00 0.00 70.33 68.83 1i43 n THR 241 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1i43 n PRO 242 N 0.33 0.09 -0.07 -2.82 -0.04 -1.26 -1.78 135.00 129.46 1i43 n PRO 242 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 1i43 n PRO 242 Cb 0.00 -1.44 -0.14 0.00 -0.04 0.00 0.00 33.50 31.88 1i43 n PRO 242 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1i43 n LEU 243 N -0.94 1.84 -0.11 1.53 4.77 -1.26 -4.33 117.00 118.50 1i43 n LEU 243 Ca 0.02 0.07 0.13 0.00 -0.03 0.00 0.00 56.01 56.20 1i43 n LEU 243 Cb 0.01 -0.45 0.49 0.00 -2.33 0.00 0.00 43.42 41.14 1i43 n LEU 243 CO 0.01 0.72 0.75 0.59 -1.33 0.00 0.00 177.39 178.14 1i43 n ASN 244 N -3.16 0.55 -3.64 -1.43 3.02 -0.73 -4.81 115.26 105.07 1i43 n ASN 244 Ca -0.35 -0.46 -0.05 0.00 -0.03 0.00 0.00 54.58 53.69 1i43 n ASN 244 Cb 1.06 -0.01 -0.06 0.00 -0.61 0.00 0.00 39.78 40.15 1i43 n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i43 s GLN 245 N -2.65 0.23 -0.87 3.52 -2.07 -1.18 -1.78 119.66 114.88 1i43 s GLN 245 Ca 0.23 0.19 -0.00 0.00 -1.82 0.00 0.00 55.36 53.95 1i43 s GLN 245 Cb 0.19 0.11 0.23 0.00 -1.09 0.00 0.00 33.01 32.45 1i43 s GLN 245 CO 0.54 -0.05 0.83 1.63 -1.32 0.00 0.00 175.29 176.92 1i43 n LYS 246 N 1.40 2.75 -0.32 9.60 4.76 -1.26 -4.41 118.16 130.67 1i43 n LYS 246 Ca -0.09 -4.52 0.25 0.00 -2.87 0.00 0.00 58.31 51.08 1i43 n LYS 246 Cb 0.57 -2.39 0.55 0.00 -1.84 0.00 0.00 35.03 31.92 1i43 n LYS 246 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1i43 h ALA 247 N 5.59 2.37 -0.35 7.82 0.00 -1.94 0.32 119.26 133.07 1i43 h ALA 247 Ca 0.17 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 1i43 h ALA 247 Cb 0.76 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1i43 h ALA 247 CO 0.89 -0.78 -0.27 -0.07 0.00 0.00 0.00 179.25 179.03 1i43 h LEU 248 N 0.32 0.75 -0.72 0.00 3.38 -1.87 -1.73 115.31 115.45 1i43 h LEU 248 Ca 0.60 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 58.25 1i43 h LEU 248 Cb 1.65 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.19 1i43 h LEU 248 CO -0.26 0.98 -0.14 0.00 0.09 0.00 0.00 178.44 179.10 1i43 h ALA 249 N 1.07 0.96 -0.01 1.53 0.00 -0.70 -3.04 119.26 119.06 1i43 h ALA 249 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1i43 h ALA 249 Cb 0.78 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1i43 h ALA 249 CO 0.06 0.18 -0.06 1.28 0.00 0.00 0.00 179.25 180.71 1i43 n LEU 250 N -3.20 0.91 0.00 0.00 4.77 -0.67 -4.92 117.00 113.88 1i43 n LEU 250 Ca 0.02 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1i43 n LEU 250 Cb 0.47 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1i43 n LEU 250 CO 0.33 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1i43 n GLY 251 N 1.19 2.00 3.75 -0.72 0.00 -1.15 -3.21 105.19 107.05 1i43 n GLY 251 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1i43 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 252 N -1.85 2.73 -0.00 4.61 0.00 -0.67 -4.91 121.76 121.66 1i43 s ALA 252 Ca 0.00 1.29 -0.11 0.00 0.00 0.00 0.00 51.96 53.14 1i43 s ALA 252 Cb 0.00 -3.55 -0.32 0.00 0.00 0.00 0.00 23.12 19.25 1i43 s ALA 252 CO 0.00 -1.39 0.86 -0.44 0.00 0.00 0.00 175.76 174.79 1i43 h ASP 253 N 1.28 0.66 -4.44 0.00 3.32 -1.57 -3.41 116.42 112.26 1i43 h ASP 253 Ca -0.51 -0.83 -0.26 0.00 0.02 0.00 0.00 57.03 55.45 1i43 h ASP 253 Cb 1.31 -0.21 -0.24 0.00 0.22 0.00 0.00 39.33 40.40 1i43 h ASP 253 CO 0.56 1.68 -0.73 -0.76 -1.72 0.00 0.00 179.24 178.27 1i43 s LEU 254 N -7.35 2.15 -0.09 1.55 1.43 -0.92 -4.06 118.68 111.39 1i43 s LEU 254 Ca -0.11 -0.34 -0.00 0.00 -1.03 0.00 0.00 54.13 52.64 1i43 s LEU 254 Cb 0.05 -0.12 0.02 0.00 0.03 0.00 0.00 46.19 46.18 1i43 s LEU 254 CO 0.89 -0.12 -0.05 0.54 0.23 0.00 0.00 176.35 177.84 1i43 s VAL 255 N -0.87 0.78 0.10 -1.59 0.11 -0.34 -1.34 120.40 117.24 1i43 s VAL 255 Ca -0.07 -0.15 0.09 0.00 -2.93 0.00 0.00 61.98 58.92 1i43 s VAL 255 Cb -0.06 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 1i43 s VAL 255 CO -0.00 0.32 -0.20 -1.48 -3.33 0.00 0.00 175.10 170.41 1i43 s LEU 256 N 1.68 2.59 0.45 2.54 0.05 -0.42 -0.90 118.68 124.67 1i43 s LEU 256 Ca 0.03 -0.56 0.03 0.00 0.05 0.00 0.00 54.13 53.68 1i43 s LEU 256 Cb -0.13 -1.48 -0.01 0.00 -2.05 0.00 0.00 46.19 42.52 1i43 s LEU 256 CO -0.06 0.20 0.12 -1.00 -0.55 0.00 0.00 176.35 175.06 1i43 s HIS 257 N -1.07 1.77 -0.47 3.48 3.76 -0.26 -2.30 115.29 120.21 1i43 s HIS 257 Ca 0.16 -1.30 0.03 0.00 -0.15 0.00 0.00 55.06 53.80 1i43 s HIS 257 Cb -0.10 -1.22 0.14 0.00 1.11 0.00 0.00 32.58 32.51 1i43 s HIS 257 CO 0.08 -0.27 0.27 0.45 -0.85 0.00 0.00 174.74 174.43 1i43 s SER 258 N -3.69 3.59 0.66 1.40 0.15 -1.26 -2.35 113.70 112.19 1i43 s SER 258 Ca 0.17 -2.80 0.22 0.00 0.70 0.00 0.00 55.95 54.24 1i43 s SER 258 Cb 0.01 -1.06 1.20 0.00 -1.71 0.00 0.00 66.02 64.46 1i43 s SER 258 CO 0.12 -0.24 1.67 0.00 1.20 0.00 0.00 173.24 176.00 1i43 h ALA 259 N 6.49 1.59 -0.16 5.45 0.00 -1.76 0.11 119.26 130.97 1i43 h ALA 259 Ca 0.03 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1i43 h ALA 259 Cb 0.91 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1i43 h ALA 259 CO 0.50 -0.55 0.16 1.15 0.00 0.00 0.00 179.25 180.51 1i43 h THR 260 N 0.00 0.58 0.00 0.00 2.02 -1.75 0.34 112.91 114.09 1i43 h THR 260 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1i43 h THR 260 Cb 1.08 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 1i43 h THR 260 CO -0.00 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.18 1i43 n LYS 261 N -3.97 0.00 0.08 6.66 4.76 0.38 -4.62 118.16 121.44 1i43 n LYS 261 Ca 0.01 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.23 1i43 n LYS 261 Cb 0.28 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.32 1i43 n LYS 261 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1i43 h PHE 262 N 0.00 0.67 -0.64 2.13 0.04 -1.74 -1.77 116.94 115.62 1i43 h PHE 262 Ca 0.00 -0.49 0.10 0.00 2.80 0.00 0.00 57.97 60.38 1i43 h PHE 262 Cb 0.00 -0.03 -0.08 0.00 2.20 0.00 0.00 35.95 38.05 1i43 h PHE 262 CO 0.00 1.41 0.25 -0.07 -0.60 0.00 0.00 178.31 179.29 1i43 h LEU 263 N -0.21 0.24 0.06 1.54 3.38 -1.82 -2.13 115.31 116.38 1i43 h LEU 263 Ca -0.19 0.08 -0.13 0.00 0.09 0.00 0.00 57.88 57.74 1i43 h LEU 263 Cb 1.81 0.06 0.01 0.00 0.09 0.00 0.00 40.66 42.64 1i43 h LEU 263 CO 0.18 0.13 -0.53 1.23 0.09 0.00 0.00 178.44 179.55 1i43 h GLY 264 N 0.42 0.28 -0.06 0.83 0.00 -1.07 -3.31 103.07 100.17 1i43 h GLY 264 Ca 0.33 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 1i43 h GLY 264 CO -0.33 0.54 -0.02 0.61 0.00 0.00 0.00 176.54 177.34 1i43 n GLY 265 N 1.42 0.10 0.00 4.60 0.00 -0.66 -4.52 105.19 106.13 1i43 n GLY 265 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1i43 n GLY 265 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1i43 n HIS 266 N -1.97 0.00 -3.68 1.61 8.25 -1.26 -1.79 115.22 116.38 1i43 n HIS 266 Ca -0.01 -0.26 -0.21 0.00 -0.26 0.00 0.00 57.72 56.98 1i43 n HIS 266 Cb 0.50 -0.03 0.04 0.00 1.12 0.00 0.00 29.99 31.62 1i43 n HIS 266 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1i43 n ASN 267 N -0.26 -1.34 -0.29 0.41 3.02 -1.26 -4.84 115.26 110.70 1i43 n ASN 267 Ca 0.00 -0.81 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 1i43 n ASN 267 Cb 0.21 -4.13 0.00 0.00 -0.61 0.00 0.00 39.78 35.24 1i43 n ASN 267 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1i43 n ASP 268 N -3.06 0.00 -3.57 6.41 5.75 -1.26 -5.12 116.55 115.70 1i43 n ASP 268 Ca -0.29 -1.34 -0.13 0.00 -0.01 0.00 0.00 54.79 53.02 1i43 n ASP 268 Cb 0.68 -0.07 -0.06 0.00 -1.03 0.00 0.00 41.12 40.64 1i43 n ASP 268 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1i43 s VAL 269 N 0.00 0.00 -0.01 2.12 0.11 -1.26 -5.11 120.40 116.25 1i43 s VAL 269 Ca 0.00 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.08 1i43 s VAL 269 Cb 0.00 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1i43 s VAL 269 CO 0.00 0.00 -0.07 -0.76 -3.33 0.00 0.00 175.10 170.94 1i43 s LEU 270 N -0.91 3.14 -0.05 2.54 1.43 -1.26 -4.34 118.68 119.24 1i43 s LEU 270 Ca -0.04 -0.13 -0.29 0.00 -1.03 0.00 0.00 54.13 52.64 1i43 s LEU 270 Cb -0.01 -1.78 0.10 0.00 0.03 0.00 0.00 46.19 44.53 1i43 s LEU 270 CO 0.03 0.30 0.82 0.00 0.23 0.00 0.00 176.35 177.73 1i43 s ALA 271 N -0.95 -1.82 0.09 4.21 0.00 -1.17 -4.63 121.76 117.50 1i43 s ALA 271 Ca 0.16 1.25 0.06 0.00 0.00 0.00 0.00 51.96 53.43 1i43 s ALA 271 Cb -0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 1i43 s ALA 271 CO 0.06 -0.46 -0.07 0.20 0.00 0.00 0.00 175.76 175.49 1i43 s GLY 272 N -1.61 1.83 -0.02 0.00 0.00 -0.41 -2.21 107.32 104.90 1i43 s GLY 272 Ca -0.03 -1.19 0.01 0.00 0.00 0.00 0.00 44.72 43.51 1i43 s GLY 272 CO 0.01 -1.16 -0.02 0.00 0.00 0.00 0.00 173.10 171.92 1i43 s ILE 274 N 0.42 -0.48 0.10 0.00 1.01 -0.69 -1.10 121.20 120.48 1i43 s ILE 274 Ca -0.04 0.11 0.09 0.00 0.00 0.00 0.00 60.65 60.81 1i43 s ILE 274 Cb -0.07 -0.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 1i43 s ILE 274 CO -0.01 -0.00 -0.24 -0.44 0.00 0.00 0.00 174.94 174.26 1i43 s SER 275 N 2.46 2.88 0.00 3.58 0.01 -0.08 0.24 113.70 122.79 1i43 s SER 275 Ca 0.04 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.61 1i43 s SER 275 Cb -0.13 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 65.91 1i43 s SER 275 CO -0.11 0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.27 1i43 n GLY 276 N 1.13 -0.52 3.79 3.44 0.00 -0.63 -1.20 105.19 111.18 1i43 n GLY 276 Ca -0.19 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.62 1i43 n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1i43 s PRO 277 N -1.10 3.34 0.08 1.61 0.04 -1.26 -1.58 135.00 136.14 1i43 s PRO 277 Ca 0.00 1.40 -0.33 0.00 0.04 0.00 0.00 61.00 62.11 1i43 s PRO 277 Cb 0.00 -2.02 -0.17 0.00 0.04 0.00 0.00 34.50 32.35 1i43 s PRO 277 CO 0.00 -0.82 1.61 1.25 0.04 0.00 0.00 177.00 179.08 1i43 h LEU 278 N 0.85 -0.94 -0.93 -3.56 6.46 -1.90 0.37 115.31 115.65 1i43 h LEU 278 Ca -0.48 0.06 0.36 0.00 -0.12 0.00 0.00 57.88 57.70 1i43 h LEU 278 Cb 1.24 0.28 -0.17 0.00 -0.73 0.00 0.00 40.66 41.28 1i43 h LEU 278 CO 0.57 -0.57 0.39 1.17 -0.62 0.00 0.00 178.44 179.39 1i43 n LYS 279 N -5.50 -0.06 -0.03 1.25 4.81 -1.26 -0.62 118.16 116.75 1i43 n LYS 279 Ca -0.12 1.32 -0.01 0.00 -0.87 0.00 0.00 58.31 58.62 1i43 n LYS 279 Cb 0.39 -2.30 -0.00 0.00 0.02 0.00 0.00 35.03 33.14 1i43 n LYS 279 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1i43 h LEU 280 N 0.00 0.00 -1.45 3.14 3.38 -1.84 -3.33 115.31 115.21 1i43 h LEU 280 Ca 0.74 0.00 0.33 0.00 0.09 0.00 0.00 57.88 59.04 1i43 h LEU 280 Cb 1.89 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 42.54 1i43 h LEU 280 CO -0.76 0.32 0.75 1.62 0.09 0.00 0.00 178.44 180.46 1i43 h VAL 281 N -0.52 0.39 -0.34 1.22 3.04 -0.59 0.29 116.25 119.73 1i43 h VAL 281 Ca 0.00 -0.09 -0.07 0.00 -1.01 0.00 0.00 66.70 65.53 1i43 h VAL 281 Cb 0.11 0.11 -0.02 0.00 -2.01 0.00 0.00 31.29 29.49 1i43 h VAL 281 CO 0.00 0.05 -0.10 0.77 -1.01 0.00 0.00 177.57 177.28 1i43 h SER 282 N 0.26 0.55 -0.79 3.17 4.64 -1.05 -0.61 113.55 119.73 1i43 h SER 282 Ca 0.66 -0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 61.82 1i43 h SER 282 Cb 1.92 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 63.82 1i43 h SER 282 CO -0.30 0.69 0.40 -0.33 -0.87 0.00 0.00 176.83 176.42 1i43 h GLU 283 N 0.53 1.13 -0.15 4.77 4.39 -0.54 -1.66 114.58 123.05 1i43 h GLU 283 Ca 0.10 -0.15 -0.09 0.00 0.34 0.00 0.00 59.36 59.56 1i43 h GLU 283 Cb 0.49 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1i43 h GLU 283 CO 0.03 0.85 -0.26 0.82 -1.16 0.00 0.00 179.01 179.28 1i43 h ILE 284 N 1.12 1.36 -0.92 3.13 2.04 -1.35 -3.06 117.51 119.83 1i43 h ILE 284 Ca 0.28 -1.51 0.20 0.00 1.00 0.00 0.00 64.86 64.83 1i43 h ILE 284 Cb 0.08 1.98 -0.07 0.00 -0.74 0.00 0.00 36.82 38.06 1i43 h ILE 284 CO -0.04 0.45 0.60 -0.09 0.00 0.00 0.00 178.15 179.07 1i43 h ARG 285 N 0.06 0.45 0.02 2.37 2.43 -0.71 0.12 114.38 119.12 1i43 h ARG 285 Ca 0.01 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1i43 h ARG 285 Cb 0.85 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1i43 h ARG 285 CO 0.06 0.30 -0.01 -0.91 -1.51 0.00 0.00 179.97 177.90 1i43 h ASN 286 N 0.47 -0.02 0.34 -3.80 4.21 -1.21 -1.30 115.58 114.26 1i43 h ASN 286 Ca 0.49 -0.27 -0.04 0.00 1.21 0.00 0.00 56.30 57.68 1i43 h ASN 286 Cb 1.12 0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 38.32 1i43 h ASN 286 CO -0.21 0.26 -0.21 0.25 -1.29 0.00 0.00 177.43 176.23 1i43 h LEU 287 N -0.31 0.00 -0.61 1.61 5.85 -1.20 -2.16 115.31 118.49 1i43 h LEU 287 Ca -0.00 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 1i43 h LEU 287 Cb 0.30 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1i43 h LEU 287 CO 0.00 0.21 0.08 -0.74 -0.34 0.00 0.00 178.44 177.66 1i43 h HIS 288 N 0.00 1.09 0.00 1.25 2.76 -0.45 -1.01 115.15 118.79 1i43 h HIS 288 Ca -0.00 -0.16 0.00 0.00 -2.20 0.00 0.00 60.37 58.01 1i43 h HIS 288 Cb 0.44 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.10 1i43 h HIS 288 CO 0.00 0.94 0.00 0.72 -1.30 0.00 0.00 177.93 178.29 1i43 n HIS 289 N -4.27 0.30 -0.12 5.26 8.25 -0.53 -1.08 115.22 123.03 1i43 n HIS 289 Ca 0.03 0.14 -0.23 0.00 -0.26 0.00 0.00 57.72 57.40 1i43 n HIS 289 Cb 0.29 -0.72 -0.08 0.00 1.12 0.00 0.00 29.99 30.60 1i43 n HIS 289 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1i43 n ILE 290 N -1.79 1.46 0.31 1.59 5.41 -0.76 -4.43 119.36 121.15 1i43 n ILE 290 Ca 0.01 -0.23 0.19 0.00 1.00 0.00 0.00 62.75 63.71 1i43 n ILE 290 Cb 0.08 -1.98 0.99 0.00 -0.71 0.00 0.00 39.64 38.03 1i43 n ILE 290 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1i43 h LEU 291 N -0.95 0.00 -2.68 1.39 3.38 -1.10 -3.47 115.31 111.89 1i43 h LEU 291 Ca -0.50 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.21 1i43 h LEU 291 Cb 1.42 0.00 0.13 0.00 0.09 0.00 0.00 40.66 42.30 1i43 h LEU 291 CO -0.30 0.02 -0.73 0.61 0.09 0.00 0.00 178.44 178.13 1i43 n GLY 292 N -0.81 -1.14 2.54 0.83 0.00 -0.24 -4.94 105.19 101.42 1i43 n GLY 292 Ca -0.02 0.53 -0.32 0.00 0.00 0.00 0.00 46.02 46.22 1i43 n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i43 n GLY 293 N -1.46 5.89 3.75 -0.02 0.00 -1.26 -5.05 105.19 107.05 1i43 n GLY 293 Ca -0.07 -2.60 -0.38 0.00 0.00 0.00 0.00 46.02 42.97 1i43 n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 294 N -3.76 2.79 -0.12 4.61 0.00 -1.26 -0.76 121.76 123.26 1i43 s ALA 294 Ca 0.52 1.23 -0.14 0.00 0.00 0.00 0.00 51.96 53.58 1i43 s ALA 294 Cb 0.43 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.98 1i43 s ALA 294 CO -0.21 -1.25 0.32 -1.17 0.00 0.00 0.00 175.76 173.45 1i43 s LEU 295 N -3.54 4.31 0.26 0.00 2.96 -1.26 -4.30 118.68 117.12 1i43 s LEU 295 Ca 0.71 0.63 -0.30 0.00 -0.22 0.00 0.00 54.13 54.96 1i43 s LEU 295 Cb -0.37 -2.41 -0.09 0.00 0.50 0.00 0.00 46.19 43.81 1i43 s LEU 295 CO 0.44 0.18 1.28 0.21 -1.32 0.00 0.00 176.35 177.13 1i43 s ASN 296 N -0.04 6.91 0.28 3.68 3.84 -1.26 -4.88 114.94 123.47 1i43 s ASN 296 Ca 0.19 2.49 0.02 0.00 0.21 0.00 0.00 52.86 55.77 1i43 s ASN 296 Cb -0.14 -2.63 0.63 0.00 -0.55 0.00 0.00 41.25 38.56 1i43 s ASN 296 CO 0.06 -0.47 1.78 -0.65 -2.79 0.00 0.00 177.10 175.04 1i43 h PRO 297 N 4.40 0.73 -0.69 0.43 0.11 -1.97 -0.14 132.00 134.88 1i43 h PRO 297 Ca -0.47 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.64 1i43 h PRO 297 Cb 1.22 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 32.12 1i43 h PRO 297 CO 0.71 0.49 0.42 -0.91 -0.21 0.00 0.00 178.00 178.50 1i43 h ASN 298 N 0.76 0.68 -0.30 -2.05 2.35 -1.92 -1.39 115.58 113.72 1i43 h ASN 298 Ca 0.52 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 56.26 1i43 h ASN 298 Cb 0.73 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 1i43 h ASN 298 CO -0.35 0.46 0.11 0.00 -1.65 0.00 0.00 177.43 176.00 1i43 h ALA 299 N 1.31 0.39 -0.99 -0.83 0.00 -1.46 -2.09 119.26 115.59 1i43 h ALA 299 Ca 0.29 -0.14 0.17 0.00 0.00 0.00 0.00 54.91 55.22 1i43 h ALA 299 Cb 0.06 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 17.64 1i43 h ALA 299 CO -0.13 0.01 0.62 0.00 0.00 0.00 0.00 179.25 179.75 1i43 h ALA 300 N 0.94 1.68 -0.09 0.00 0.00 -0.46 -0.33 119.26 121.01 1i43 h ALA 300 Ca 0.10 0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 1i43 h ALA 300 Cb 0.22 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1i43 h ALA 300 CO -0.01 0.00 -0.77 -0.92 0.00 0.00 0.00 179.25 177.55 1i43 h TYR 301 N 0.80 0.74 0.00 0.00 3.20 -1.00 -1.94 116.97 118.78 1i43 h TYR 301 Ca 0.53 -0.33 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 1i43 h TYR 301 Cb 0.78 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.94 1i43 h TYR 301 CO -0.00 1.12 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.55 1i43 h LEU 302 N 0.36 0.00 0.16 2.82 3.38 -0.39 0.97 115.31 122.61 1i43 h LEU 302 Ca -0.04 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.62 1i43 h LEU 302 Cb 1.37 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.13 1i43 h LEU 302 CO 0.14 0.02 -1.51 0.40 0.09 0.00 0.00 178.44 177.58 1i43 h ILE 303 N 0.00 1.05 -0.67 1.22 2.04 -1.22 -2.43 117.51 117.50 1i43 h ILE 303 Ca -0.00 -2.48 0.06 0.00 1.00 0.00 0.00 64.86 63.44 1i43 h ILE 303 Cb 0.03 2.80 -0.06 0.00 -0.74 0.00 0.00 36.82 38.86 1i43 h ILE 303 CO 0.00 0.78 0.37 0.40 0.00 0.00 0.00 178.15 179.70 1i43 h ILE 304 N -0.11 0.96 -0.03 -0.67 2.04 -0.76 0.10 117.51 119.05 1i43 h ILE 304 Ca -0.30 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 1i43 h ILE 304 Cb 1.92 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 38.22 1i43 h ILE 304 CO 0.13 0.12 0.01 -0.09 0.00 0.00 0.00 178.15 178.33 1i43 h ARG 305 N 0.67 0.04 0.00 2.37 2.43 -0.92 -2.79 114.38 116.17 1i43 h ARG 305 Ca 0.30 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 1i43 h ARG 305 Cb 0.20 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1i43 h ARG 305 CO -0.19 0.17 -0.08 0.78 -1.51 0.00 0.00 179.97 179.15 1i43 h GLY 306 N -0.10 0.00 2.00 2.80 0.00 -0.86 -1.99 103.07 104.91 1i43 h GLY 306 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1i43 h GLY 306 CO -0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.54 176.21 1i43 h MET 307 N 0.00 0.00 -0.02 4.80 2.86 -0.56 -3.09 114.93 118.92 1i43 h MET 307 Ca -0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1i43 h MET 307 Cb 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 1i43 h MET 307 CO 0.01 0.00 0.08 0.87 1.06 0.00 0.00 176.91 178.93 1i43 h LYS 308 N 0.00 0.00 -0.08 1.72 1.79 -1.20 -0.74 116.57 118.06 1i43 h LYS 308 Ca 0.00 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.37 1i43 h LYS 308 Cb 0.80 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.31 1i43 h LYS 308 CO 0.00 0.00 -0.66 0.25 -1.08 0.00 0.00 179.45 177.96 1i43 n THR 309 N -3.25 1.74 0.31 -0.16 -2.24 -1.17 -4.77 114.28 104.74 1i43 n THR 309 Ca -0.02 -2.85 -0.12 0.00 -2.27 0.00 0.00 64.05 58.78 1i43 n THR 309 Cb 0.15 -0.01 -0.06 0.00 -2.10 0.00 0.00 70.33 68.31 1i43 n THR 309 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1i43 h LEU 310 N 1.16 -0.67 -0.89 3.22 5.85 -1.20 -2.05 115.31 120.73 1i43 h LEU 310 Ca -0.02 0.02 0.20 0.00 0.84 0.00 0.00 57.88 58.93 1i43 h LEU 310 Cb 1.25 0.17 -0.12 0.00 0.37 0.00 0.00 40.66 42.34 1i43 h LEU 310 CO 0.10 -0.45 0.43 1.12 -0.34 0.00 0.00 178.44 179.29 1i43 h HIS 311 N -0.85 0.72 -0.37 1.25 2.07 -1.89 0.12 115.15 116.20 1i43 h HIS 311 Ca -0.08 0.04 -0.00 0.00 -2.85 0.00 0.00 60.37 57.47 1i43 h HIS 311 Cb 0.61 -0.18 -0.02 0.00 2.57 0.00 0.00 27.41 30.39 1i43 h HIS 311 CO 0.08 0.03 0.21 -0.07 -3.07 0.00 0.00 177.93 175.11 1i43 h LEU 312 N 0.48 0.45 0.26 6.12 3.38 -1.90 -0.41 115.31 123.69 1i43 h LEU 312 Ca 0.54 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.43 1i43 h LEU 312 Cb 0.96 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1i43 h LEU 312 CO -0.47 0.39 -0.13 0.03 0.09 0.00 0.00 178.44 178.35 1i43 h ARG 313 N 0.47 -0.34 -0.65 1.13 3.08 -0.45 -3.01 114.38 114.61 1i43 h ARG 313 Ca 0.13 0.02 0.12 0.00 0.07 0.00 0.00 59.98 60.33 1i43 h ARG 313 Cb 0.03 0.08 -0.09 0.00 0.08 0.00 0.00 29.97 30.07 1i43 h ARG 313 CO -0.02 -0.00 0.18 0.28 -1.07 0.00 0.00 179.97 179.34 1i43 h VAL 314 N -0.74 0.64 -0.45 2.04 2.07 -0.80 0.41 116.25 119.43 1i43 h VAL 314 Ca -0.04 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.45 1i43 h VAL 314 Cb 0.49 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.49 1i43 h VAL 314 CO 0.06 0.06 0.07 1.56 0.02 0.00 0.00 177.57 179.33 1i43 h GLN 315 N 0.32 0.19 -0.31 1.57 4.20 -1.09 0.22 115.11 120.20 1i43 h GLN 315 Ca 0.35 -0.01 -0.13 0.00 0.06 0.00 0.00 58.65 58.91 1i43 h GLN 315 Cb 0.52 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 1i43 h GLN 315 CO -0.41 0.12 -0.33 0.37 -0.67 0.00 0.00 178.83 177.92 1i43 h GLN 316 N 0.19 0.78 -0.25 1.46 5.75 -1.18 -2.99 115.11 118.87 1i43 h GLN 316 Ca 0.22 -0.42 -0.07 0.00 -0.15 0.00 0.00 58.65 58.24 1i43 h GLN 316 Cb 0.30 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.85 1i43 h GLN 316 CO -0.31 1.05 -0.13 1.96 -2.65 0.00 0.00 178.83 178.74 1i43 h GLN 317 N 0.54 0.41 -0.44 1.69 4.20 -0.51 -2.44 115.11 118.56 1i43 h GLN 317 Ca 0.05 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 1i43 h GLN 317 Cb 0.91 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.63 1i43 h GLN 317 CO 0.08 0.55 0.17 -0.91 -0.67 0.00 0.00 178.83 178.04 1i43 h ASN 318 N 0.38 0.62 0.16 1.46 2.35 -0.50 -2.12 115.58 117.93 1i43 h ASN 318 Ca 0.07 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 1i43 h ASN 318 Cb 0.47 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1i43 h ASN 318 CO 0.03 0.63 -0.08 0.28 -1.65 0.00 0.00 177.43 176.64 1i43 h SER 319 N 0.57 -0.18 -0.99 5.81 0.02 -1.37 -2.33 113.55 115.08 1i43 h SER 319 Ca 0.15 0.01 0.35 0.00 -0.84 0.00 0.00 61.79 61.45 1i43 h SER 319 Cb 0.21 0.05 -0.17 0.00 0.14 0.00 0.00 62.40 62.63 1i43 h SER 319 CO -0.01 -0.10 0.38 0.74 -1.14 0.00 0.00 176.83 176.70 1i43 h THR 320 N -0.28 0.08 0.35 -2.27 2.02 -1.54 0.35 112.91 111.61 1i43 h THR 320 Ca -0.02 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1i43 h THR 320 Cb 0.17 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.58 1i43 h THR 320 CO 0.04 0.01 -0.17 0.00 0.37 0.00 0.00 175.52 175.77 1i43 h ALA 321 N 1.96 -0.46 -0.06 6.16 0.00 -1.41 -1.03 119.26 124.41 1i43 h ALA 321 Ca 0.74 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.49 1i43 h ALA 321 Cb 1.80 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.76 1i43 h ALA 321 CO -0.78 -0.66 0.04 1.25 0.00 0.00 0.00 179.25 179.10 1i43 h LEU 322 N -0.67 0.07 -0.65 0.00 5.85 -0.20 -0.51 115.31 119.20 1i43 h LEU 322 Ca -0.05 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1i43 h LEU 322 Cb 0.48 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1i43 h LEU 322 CO 0.08 0.10 0.42 0.03 -0.34 0.00 0.00 178.44 178.73 1i43 h ARG 323 N 0.04 0.87 0.00 1.25 3.08 -0.51 -2.48 114.38 116.63 1i43 h ARG 323 Ca 0.02 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 59.92 1i43 h ARG 323 Cb 0.04 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 1i43 h ARG 323 CO -0.00 0.59 -0.43 0.52 -1.07 0.00 0.00 179.97 179.57 1i43 h MET 324 N 0.88 0.00 0.29 0.04 2.86 -1.06 -2.92 114.93 115.02 1i43 h MET 324 Ca 0.24 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 1i43 h MET 324 Cb -0.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.59 1i43 h MET 324 CO -0.05 0.43 -0.14 0.00 1.06 0.00 0.00 176.91 178.21 1i43 h ALA 325 N 1.57 -0.39 -0.29 6.32 0.00 -0.63 -0.09 119.26 125.74 1i43 h ALA 325 Ca -0.00 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.83 1i43 h ALA 325 Cb 0.92 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 1i43 h ALA 325 CO 0.06 -0.66 -0.02 0.93 0.00 0.00 0.00 179.25 179.55 1i43 h GLU 326 N -0.52 0.06 -0.69 0.00 5.08 -1.50 0.48 114.58 117.49 1i43 h GLU 326 Ca -0.04 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.41 1i43 h GLU 326 Cb 0.38 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 1i43 h GLU 326 CO 0.07 0.04 0.34 0.82 -1.00 0.00 0.00 179.01 179.27 1i43 h ILE 327 N 0.06 0.85 -0.39 3.13 2.04 -1.41 -0.03 117.51 121.75 1i43 h ILE 327 Ca 0.14 -0.20 -0.14 0.00 1.00 0.00 0.00 64.86 65.65 1i43 h ILE 327 Cb 0.20 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 1i43 h ILE 327 CO -0.26 0.11 -0.33 -0.07 0.00 0.00 0.00 178.15 177.60 1i43 h LEU 328 N 0.59 0.93 -0.85 1.44 3.38 0.19 -2.08 115.31 118.90 1i43 h LEU 328 Ca 0.34 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1i43 h LEU 328 Cb 0.35 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1i43 h LEU 328 CO -0.26 1.17 0.47 -0.08 0.09 0.00 0.00 178.44 179.82 1i43 h GLU 329 N 0.74 1.19 0.00 1.13 4.81 0.86 -2.13 114.58 121.19 1i43 h GLU 329 Ca 0.08 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1i43 h GLU 329 Cb 0.90 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1i43 h GLU 329 CO 0.08 0.88 0.00 0.00 -0.73 0.00 0.00 179.01 179.24 1i43 n ALA 330 N -2.39 2.19 -2.02 2.92 0.00 -0.12 -4.85 120.51 116.24 1i43 n ALA 330 Ca 0.09 -0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.09 1i43 n ALA 330 Cb 0.10 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.07 1i43 n ALA 330 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1i43 s HIS 331 N -3.11 3.24 0.42 0.00 5.65 -0.79 -4.92 115.29 115.76 1i43 s HIS 331 Ca 0.10 1.16 0.24 0.00 0.25 0.00 0.00 55.06 56.81 1i43 s HIS 331 Cb 0.13 -3.63 1.31 0.00 -1.18 0.00 0.00 32.58 29.20 1i43 s HIS 331 CO 0.55 -2.02 2.04 -1.00 -0.65 0.00 0.00 174.74 173.65 1i43 h PRO 332 N 5.58 0.00 -0.00 2.88 0.13 -1.88 -2.51 132.00 136.19 1i43 h PRO 332 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1i43 h PRO 332 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1i43 h PRO 332 CO 0.79 0.15 -0.32 1.63 -0.23 0.00 0.00 178.00 180.02 1i43 n LYS 333 N -3.81 0.14 -3.54 0.86 4.01 -1.26 -4.75 118.16 109.82 1i43 n LYS 333 Ca -0.02 -0.07 -0.40 0.00 -0.51 0.00 0.00 58.31 57.31 1i43 n LYS 333 Cb 0.25 -1.50 -0.11 0.00 -0.51 0.00 0.00 35.03 33.17 1i43 n LYS 333 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1i43 s VAL 334 N -2.90 5.25 -0.03 -0.18 1.01 -0.95 -0.70 120.40 121.90 1i43 s VAL 334 Ca 0.15 -0.21 -0.23 0.00 0.00 0.00 0.00 61.98 61.69 1i43 s VAL 334 Cb 0.18 -3.69 -0.16 0.00 0.00 0.00 0.00 36.38 32.72 1i43 s VAL 334 CO 0.62 0.00 1.02 -0.09 0.00 0.00 0.00 175.10 176.65 1i43 h ARG 335 N 8.48 -0.28 -3.79 2.72 2.43 -1.34 -3.45 114.38 119.15 1i43 h ARG 335 Ca -0.31 0.02 -0.17 0.00 -0.81 0.00 0.00 59.98 58.71 1i43 h ARG 335 Cb 1.16 0.06 -0.22 0.00 -0.42 0.00 0.00 29.97 30.56 1i43 h ARG 335 CO 0.63 0.10 -0.63 -1.58 -1.51 0.00 0.00 179.97 176.98 1i43 s HIS 336 N -3.92 0.15 -0.04 2.20 5.04 -1.15 -4.98 115.29 112.58 1i43 s HIS 336 Ca -0.13 -0.32 0.02 0.00 -1.54 0.00 0.00 55.06 53.08 1i43 s HIS 336 Cb 0.01 -0.12 0.01 0.00 0.04 0.00 0.00 32.58 32.52 1i43 s HIS 336 CO 0.50 -0.20 -0.08 0.08 -2.34 0.00 0.00 174.74 172.71 1i43 s VAL 337 N -1.24 0.75 -0.20 0.89 1.01 -1.26 -0.14 120.40 120.20 1i43 s VAL 337 Ca -0.14 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.50 1i43 s VAL 337 Cb -0.08 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 1i43 s VAL 337 CO -0.00 0.26 0.01 -0.31 0.00 0.00 0.00 175.10 175.05 1i43 s TYR 338 N 0.57 3.05 -0.30 5.22 1.51 0.29 -4.89 117.35 122.81 1i43 s TYR 338 Ca -0.09 -0.44 -0.15 0.00 -1.01 0.00 0.00 57.07 55.38 1i43 s TYR 338 Cb -0.12 -2.10 0.16 0.00 -0.11 0.00 0.00 41.96 39.79 1i43 s TYR 338 CO 0.01 -0.24 1.01 -0.47 -1.11 0.00 0.00 175.55 174.75 1i43 s TYR 339 N 1.03 -0.60 0.54 2.71 5.04 -1.26 -2.68 117.35 122.12 1i43 s TYR 339 Ca 0.02 1.08 0.31 0.00 -2.44 0.00 0.00 57.07 56.05 1i43 s TYR 339 Cb -0.14 0.36 1.48 0.00 0.35 0.00 0.00 41.96 44.01 1i43 s TYR 339 CO 0.02 -0.30 1.90 -1.35 -1.34 0.00 0.00 175.55 174.47 1i43 h PRO 340 N 7.00 0.00 0.00 4.97 0.11 -1.84 0.30 132.00 142.54 1i43 h PRO 340 Ca -0.19 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.87 1i43 h PRO 340 Cb 1.14 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1i43 h PRO 340 CO 0.12 0.00 -0.22 0.78 -0.21 0.00 0.00 178.00 178.47 1i43 h GLY 341 N 0.00 0.00 -1.84 -0.55 0.00 -1.94 -3.42 103.07 95.32 1i43 h GLY 341 Ca 0.42 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.26 1i43 h GLY 341 CO -0.00 0.00 0.38 1.08 0.00 0.00 0.00 176.54 178.00 1i43 s LEU 342 N -6.92 3.61 0.45 3.11 1.43 0.10 -4.95 118.68 115.51 1i43 s LEU 342 Ca -0.00 1.86 0.26 0.00 -1.03 0.00 0.00 54.13 55.21 1i43 s LEU 342 Cb 0.11 -4.54 0.64 0.00 0.03 0.00 0.00 46.19 42.43 1i43 s LEU 342 CO 0.63 -1.04 1.72 1.56 0.23 0.00 0.00 176.35 179.45 1i43 h GLN 343 N 0.81 0.00 -0.00 1.70 1.08 -1.87 -3.06 115.11 113.77 1i43 h GLN 343 Ca -0.48 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 1i43 h GLN 343 Cb 1.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.65 1i43 h GLN 343 CO 0.58 0.00 -0.03 -1.13 -0.95 0.00 0.00 178.83 177.30 1i43 n SER 344 N -3.01 0.09 -4.71 1.46 3.41 -1.26 -4.85 113.62 104.74 1i43 n SER 344 Ca 0.03 -0.19 -0.42 0.00 -0.26 0.00 0.00 58.87 58.03 1i43 n SER 344 Cb 0.46 -0.25 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 1i43 n SER 344 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1i43 s HIS 345 N -2.58 3.60 0.24 7.33 5.04 -1.16 -4.96 115.29 122.80 1i43 s HIS 345 Ca 0.28 1.57 -0.10 0.00 -1.54 0.00 0.00 55.06 55.27 1i43 s HIS 345 Cb 0.20 -3.22 0.36 0.00 0.04 0.00 0.00 32.58 29.96 1i43 s HIS 345 CO 0.47 -0.44 1.60 -1.35 -2.34 0.00 0.00 174.74 172.68 1i43 h PRO 346 N 6.58 0.02 -0.85 2.88 0.11 -1.91 -0.62 132.00 138.20 1i43 h PRO 346 Ca -0.42 -0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.18 1i43 h PRO 346 Cb 1.22 -0.00 -0.28 0.00 0.11 0.00 0.00 31.00 32.05 1i43 h PRO 346 CO 0.77 0.01 0.46 -0.85 -0.21 0.00 0.00 178.00 178.17 1i43 n GLU 347 N -5.48 2.43 -0.04 1.05 0.00 -1.26 -4.62 120.64 112.72 1i43 n GLU 347 Ca 0.12 -3.24 0.04 0.00 0.00 0.00 0.00 57.16 54.08 1i43 n GLU 347 Cb 0.43 -2.16 0.40 0.00 0.00 0.00 0.00 31.44 30.11 1i43 n GLU 347 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1i43 h HIS 348 N 1.43 0.58 -0.16 -1.84 2.76 -1.35 0.14 115.15 116.71 1i43 h HIS 348 Ca 0.53 0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.58 1i43 h HIS 348 Cb 1.85 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 30.61 1i43 h HIS 348 CO 1.38 0.36 -0.45 1.12 -1.30 0.00 0.00 177.93 179.04 1i43 h HIS 349 N 0.62 0.49 0.23 5.26 2.07 -1.82 -1.43 115.15 120.58 1i43 h HIS 349 Ca 0.17 -0.15 -0.01 0.00 -2.85 0.00 0.00 60.37 57.53 1i43 h HIS 349 Cb -0.05 -0.10 0.00 0.00 2.57 0.00 0.00 27.41 29.83 1i43 h HIS 349 CO -0.00 0.79 -0.11 0.82 -3.07 0.00 0.00 177.93 176.36 1i43 h ILE 350 N 0.33 0.75 -0.95 6.12 2.04 -1.53 -2.59 117.51 121.67 1i43 h ILE 350 Ca 0.02 -0.88 0.15 0.00 1.00 0.00 0.00 64.86 65.16 1i43 h ILE 350 Cb 0.93 1.18 -0.09 0.00 -0.74 0.00 0.00 36.82 38.09 1i43 h ILE 350 CO 0.08 0.17 0.56 0.00 0.00 0.00 0.00 178.15 178.95 1i43 h ALA 351 N -0.30 1.48 0.00 1.87 0.00 -0.78 0.13 119.26 121.66 1i43 h ALA 351 Ca -0.03 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1i43 h ALA 351 Cb 0.51 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1i43 h ALA 351 CO 0.05 0.04 -0.21 -0.22 0.00 0.00 0.00 179.25 178.91 1i43 h LYS 352 N 0.80 0.00 0.02 0.00 3.64 -1.26 0.89 116.57 120.66 1i43 h LYS 352 Ca 0.51 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.60 1i43 h LYS 352 Cb 0.67 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.44 1i43 h LYS 352 CO -0.33 0.21 -1.61 -0.22 -2.27 0.00 0.00 179.45 175.23 1i43 h LYS 353 N 0.00 0.04 -0.11 1.90 3.64 -0.40 -3.39 116.57 118.25 1i43 h LYS 353 Ca -0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1i43 h LYS 353 Cb 0.57 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1i43 h LYS 353 CO 0.03 0.67 0.00 0.00 -2.27 0.00 0.00 179.45 177.88 1i43 n GLN 354 N -3.16 1.18 -4.25 1.90 10.64 -0.29 -5.02 117.38 118.39 1i43 n GLN 354 Ca -0.15 -1.35 -0.20 0.00 -1.83 0.00 0.00 57.00 53.47 1i43 n GLN 354 Cb 1.03 -1.18 -0.12 0.00 -0.86 0.00 0.00 30.24 29.12 1i43 n GLN 354 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1i43 s MET 355 N -0.82 1.04 -0.02 2.61 -1.94 0.30 -4.63 119.30 115.84 1i43 s MET 355 Ca 0.13 -1.20 0.15 0.00 -1.71 0.00 0.00 55.69 53.06 1i43 s MET 355 Cb 0.08 -1.04 -0.22 0.00 2.01 0.00 0.00 34.83 35.65 1i43 s MET 355 CO 0.11 0.22 0.37 0.25 -0.01 0.00 0.00 175.02 175.96 1i43 n THR 356 N 0.72 0.00 -4.27 2.05 -2.24 -0.73 -4.72 114.28 105.09 1i43 n THR 356 Ca -0.17 -0.32 -0.18 0.00 -2.27 0.00 0.00 64.05 61.11 1i43 n THR 356 Cb 0.56 0.28 -0.08 0.00 -2.10 0.00 0.00 70.33 68.98 1i43 n THR 356 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1i43 s GLY 357 N -3.54 2.18 -0.07 3.38 0.00 -1.26 -5.05 107.32 102.97 1i43 s GLY 357 Ca -0.04 -2.00 0.11 0.00 0.00 0.00 0.00 44.72 42.79 1i43 s GLY 357 CO 0.62 -1.47 1.10 0.69 0.00 0.00 0.00 173.10 174.04 1i43 n PHE 358 N -0.56 0.00 -0.27 1.90 3.72 -1.26 -4.95 117.46 116.04 1i43 n PHE 358 Ca 0.06 -0.60 0.03 0.00 -0.05 0.00 0.00 57.45 56.90 1i43 n PHE 358 Cb 0.63 -0.12 -0.01 0.00 -0.94 0.00 0.00 39.48 39.04 1i43 n PHE 358 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1i43 n GLY 359 N -0.65 -2.16 0.88 1.37 0.00 -1.26 -4.68 105.19 98.69 1i43 n GLY 359 Ca 0.09 -1.42 0.10 0.00 0.00 0.00 0.00 46.02 44.79 1i43 n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i43 n GLY 360 N -2.79 1.00 3.76 -0.02 0.00 -1.26 -4.40 105.19 101.47 1i43 n GLY 360 Ca -0.01 -0.60 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 1i43 n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i43 s ALA 361 N -1.55 3.55 -0.04 4.61 0.00 -1.26 -2.25 121.76 124.82 1i43 s ALA 361 Ca 0.27 -0.20 0.01 0.00 0.00 0.00 0.00 51.96 52.04 1i43 s ALA 361 Cb 0.18 -2.56 0.02 0.00 0.00 0.00 0.00 23.12 20.76 1i43 s ALA 361 CO 0.26 0.16 -0.03 0.08 0.00 0.00 0.00 175.76 176.23 1i43 s VAL 362 N 0.05 0.41 0.06 0.00 1.01 0.50 -4.94 120.40 117.49 1i43 s VAL 362 Ca 0.25 -0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.25 1i43 s VAL 362 Cb -0.16 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 1i43 s VAL 362 CO 0.11 0.20 -0.10 -0.44 0.00 0.00 0.00 175.10 174.87 1i43 s SER 363 N 1.04 4.38 0.04 3.32 0.01 -1.09 -0.08 113.70 121.32 1i43 s SER 363 Ca -0.09 -0.31 -0.27 0.00 1.31 0.00 0.00 55.95 56.58 1i43 s SER 363 Cb -0.14 -0.88 0.07 0.00 0.21 0.00 0.00 66.02 65.28 1i43 s SER 363 CO -0.01 0.22 0.65 0.72 0.41 0.00 0.00 173.24 175.23 1i43 s PHE 364 N -1.10 -0.60 -0.19 2.43 -0.71 -0.52 0.11 117.98 117.39 1i43 s PHE 364 Ca 0.19 0.76 -0.06 0.00 -1.04 0.00 0.00 56.93 56.78 1i43 s PHE 364 Cb -0.11 0.48 -0.03 0.00 -1.21 0.00 0.00 43.02 42.15 1i43 s PHE 364 CO 0.10 -0.72 0.02 -1.21 -1.34 0.00 0.00 175.22 172.08 1i43 s GLU 365 N -2.35 3.74 0.50 1.99 2.02 0.80 -0.53 118.70 124.87 1i43 s GLU 365 Ca -0.05 -0.46 -0.15 0.00 0.02 0.00 0.00 54.97 54.32 1i43 s GLU 365 Cb -0.00 -3.12 -0.07 0.00 0.10 0.00 0.00 34.13 31.03 1i43 s GLU 365 CO -0.01 0.12 0.94 0.08 0.02 0.00 0.00 175.26 176.41 1i43 s VAL 366 N 0.75 4.59 -1.40 2.63 1.01 -1.07 -1.03 120.40 125.88 1i43 s VAL 366 Ca 0.01 1.08 -0.13 0.00 0.00 0.00 0.00 61.98 62.94 1i43 s VAL 366 Cb -0.14 -3.73 0.08 0.00 0.00 0.00 0.00 36.38 32.59 1i43 s VAL 366 CO 0.02 -0.68 2.10 -0.67 0.00 0.00 0.00 175.10 175.88 1i43 n ASP 367 N -1.58 4.26 0.00 3.32 2.03 0.12 -4.62 116.55 120.08 1i43 n ASP 367 Ca 0.06 -2.92 0.00 0.00 0.52 0.00 0.00 54.79 52.45 1i43 n ASP 367 Cb 0.54 -1.62 0.00 0.00 -0.72 0.00 0.00 41.12 39.32 1i43 n ASP 367 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i43 n GLY 368 N 3.84 2.84 3.49 0.27 0.00 -1.26 -5.03 105.19 109.33 1i43 n GLY 368 Ca 0.48 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 1i43 n GLY 368 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1i43 n ASP 369 N 0.00 1.23 -0.29 1.61 5.75 -1.26 -4.85 116.55 118.74 1i43 n ASP 369 Ca 0.00 -3.26 0.09 0.00 -0.01 0.00 0.00 54.79 51.62 1i43 n ASP 369 Cb 0.00 1.08 0.23 0.00 -1.03 0.00 0.00 41.12 41.39 1i43 n ASP 369 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1i43 h LEU 370 N 0.00 -0.22 -0.00 -2.12 7.12 -1.99 0.30 115.31 118.39 1i43 h LEU 370 Ca -0.33 0.21 -0.00 0.00 0.13 0.00 0.00 57.88 57.88 1i43 h LEU 370 Cb 1.26 0.33 -0.00 0.00 -0.53 0.00 0.00 40.66 41.72 1i43 h LEU 370 CO 0.52 -0.19 -0.01 -0.07 -0.13 0.00 0.00 178.44 178.57 1i43 h LEU 371 N 0.14 0.01 0.22 2.25 -0.00 -1.96 -2.47 115.31 113.50 1i43 h LEU 371 Ca 0.49 -0.53 -0.01 0.00 -0.00 0.00 0.00 57.88 57.83 1i43 h LEU 371 Cb 0.94 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.60 1i43 h LEU 371 CO -0.69 0.54 -0.11 0.74 -0.00 0.00 0.00 178.44 178.92 1i43 h THR 372 N -0.52 0.79 -0.99 0.22 2.02 -1.75 -1.17 112.91 111.50 1i43 h THR 372 Ca 0.00 -0.01 0.16 0.00 0.77 0.00 0.00 66.41 67.33 1i43 h THR 372 Cb 0.54 0.79 -0.10 0.00 -1.74 0.00 0.00 68.15 67.64 1i43 h THR 372 CO 0.00 0.00 0.61 0.74 0.37 0.00 0.00 175.52 177.24 1i43 h THR 373 N -0.30 0.78 -0.56 3.16 2.02 -0.53 0.26 112.91 117.75 1i43 h THR 373 Ca -0.03 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 1i43 h THR 373 Cb 0.23 -0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.48 1i43 h THR 373 CO 0.05 0.15 0.31 0.00 0.37 0.00 0.00 175.52 176.41 1i43 h ALA 374 N 1.60 0.71 -0.88 6.16 0.00 -0.94 -1.70 119.26 124.22 1i43 h ALA 374 Ca 0.54 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.53 1i43 h ALA 374 Cb 0.74 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 1i43 h ALA 374 CO -0.34 0.22 0.57 -0.22 0.00 0.00 0.00 179.25 179.48 1i43 h LYS 375 N 0.75 0.55 0.26 0.00 3.64 0.73 0.54 116.57 123.03 1i43 h LYS 375 Ca 0.20 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1i43 h LYS 375 Cb 0.03 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1i43 h LYS 375 CO -0.03 0.36 -0.12 0.35 -2.27 0.00 0.00 179.45 177.74 1i43 h PHE 376 N 0.57 -0.32 -0.38 1.91 3.57 -0.54 -2.52 116.94 119.23 1i43 h PHE 376 Ca 0.45 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.92 1i43 h PHE 376 Cb 0.88 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 1i43 h PHE 376 CO -0.00 0.01 0.15 -0.39 -2.23 0.00 0.00 178.31 175.85 1i43 h VAL 377 N -0.69 1.15 0.00 1.41 -1.51 -0.96 -0.60 116.25 115.05 1i43 h VAL 377 Ca -0.04 -0.46 -0.02 0.00 -1.23 0.00 0.00 66.70 64.95 1i43 h VAL 377 Cb 0.48 0.69 -0.00 0.00 -2.13 0.00 0.00 31.29 30.33 1i43 h VAL 377 CO 0.06 0.18 -0.12 0.44 -1.23 0.00 0.00 177.57 176.90 1i43 h ASP 378 N 0.54 0.00 0.92 4.19 5.19 -0.87 -2.78 116.42 123.61 1i43 h ASP 378 Ca 0.13 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.35 1i43 h ASP 378 Cb 0.11 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.59 1i43 h ASP 378 CO -0.01 0.12 -0.91 0.00 -3.12 0.00 0.00 179.24 175.31 1i43 h ALA 379 N 1.88 0.49 -2.44 3.45 0.00 -0.65 -3.46 119.26 118.54 1i43 h ALA 379 Ca -0.00 -0.83 -0.54 0.00 0.00 0.00 0.00 54.91 53.54 1i43 h ALA 379 Cb 0.45 -0.15 0.19 0.00 0.00 0.00 0.00 17.79 18.28 1i43 h ALA 379 CO 0.02 1.14 0.05 1.28 0.00 0.00 0.00 179.25 181.73 1i43 n LEU 380 N -3.45 2.87 0.00 0.00 4.77 -1.05 -4.82 117.00 115.32 1i43 n LEU 380 Ca -0.00 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 1i43 n LEU 380 Cb 0.87 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1i43 n LEU 380 CO 0.46 -2.34 -0.17 0.29 -1.33 0.00 0.00 177.39 174.30 1i43 n LYS 381 N -2.85 3.15 -0.10 3.23 5.02 -1.26 -4.90 118.16 120.45 1i43 n LYS 381 Ca 0.12 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.23 1i43 n LYS 381 Cb 0.51 -0.58 -0.07 0.00 -0.02 0.00 0.00 35.03 34.88 1i43 n LYS 381 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1i43 n ILE 382 N -0.71 1.50 -2.19 -0.18 5.41 -1.26 -4.97 119.36 116.96 1i43 n ILE 382 Ca 0.00 -0.03 -0.34 0.00 1.00 0.00 0.00 62.75 63.38 1i43 n ILE 382 Cb 0.00 -2.15 0.00 0.00 -0.71 0.00 0.00 39.64 36.78 1i43 n ILE 382 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1i43 s PRO 383 N -2.48 3.34 0.18 0.38 0.04 -1.26 -4.72 135.00 130.48 1i43 s PRO 383 Ca -0.28 1.43 -0.12 0.00 0.04 0.00 0.00 61.00 62.07 1i43 s PRO 383 Cb 0.07 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.52 1i43 s PRO 383 CO 0.44 -0.82 0.55 0.71 0.04 0.00 0.00 177.00 177.91 1i43 s TYR 384 N -2.06 3.52 -0.94 0.56 2.02 0.40 -4.78 117.35 116.07 1i43 s TYR 384 Ca 0.69 0.97 -0.18 0.00 -0.37 0.00 0.00 57.07 58.18 1i43 s TYR 384 Cb -0.20 -2.32 0.15 0.00 -0.40 0.00 0.00 41.96 39.19 1i43 s TYR 384 CO 0.30 0.36 1.11 0.42 -1.57 0.00 0.00 175.55 176.17 1i43 s ILE 385 N -1.63 4.88 0.31 2.71 1.01 -1.26 -0.24 121.20 126.98 1i43 s ILE 385 Ca 0.42 -1.80 -0.12 0.00 0.00 0.00 0.00 60.65 59.16 1i43 s ILE 385 Cb -0.13 -4.75 0.01 0.00 0.01 0.00 0.00 42.46 37.60 1i43 s ILE 385 CO 0.20 -1.46 0.57 0.00 0.00 0.00 0.00 174.94 174.25 1i43 s ALA 386 N 2.24 -0.19 0.83 9.38 0.00 -1.05 -4.97 121.76 128.01 1i43 s ALA 386 Ca 0.32 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 1i43 s ALA 386 Cb -0.05 0.99 0.02 0.00 0.00 0.00 0.00 23.12 24.07 1i43 s ALA 386 CO -0.09 -0.89 0.12 -0.35 0.00 0.00 0.00 175.76 174.56 1i43 n PRO 387 N -0.47 0.07 -0.62 0.00 -0.05 -1.26 -4.48 135.00 128.18 1i43 n PRO 387 Ca -0.03 -0.22 0.08 0.00 -0.05 0.00 0.00 63.50 63.29 1i43 n PRO 387 Cb 0.61 -0.11 -0.02 0.00 -0.05 0.00 0.00 33.50 33.93 1i43 n PRO 387 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 1i43 n SER 388 N -3.06 -3.71 -3.61 3.54 2.88 -1.26 -5.01 113.62 103.39 1i43 n SER 388 Ca 0.02 0.67 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 1i43 n SER 388 Cb 0.06 -1.88 -0.01 0.00 -0.75 0.00 0.00 64.21 61.62 1i43 n SER 388 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1i43 s PHE 389 N -1.52 -0.02 0.00 0.66 -0.12 -1.26 -4.95 117.98 110.77 1i43 s PHE 389 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 56.93 56.88 1i43 s PHE 389 Cb 0.00 0.51 0.00 0.00 -0.63 0.00 0.00 43.02 42.90 1i43 s PHE 389 CO 0.00 -0.05 0.00 0.41 -0.05 0.00 0.00 175.22 175.53 1i43 n GLY 390 N -0.24 0.43 3.96 1.99 0.00 -1.26 -4.22 105.19 105.85 1i43 n GLY 390 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 1i43 n GLY 390 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i43 s GLY 391 N -1.16 1.76 0.52 -0.02 0.00 -1.26 -4.27 107.32 102.89 1i43 s GLY 391 Ca 0.00 -1.22 0.21 0.00 0.00 0.00 0.00 44.72 43.71 1i43 s GLY 391 CO 0.00 -0.95 2.06 0.00 0.00 0.00 0.00 173.10 174.21 1i43 s GLU 393 N -5.05 4.42 0.39 0.00 8.01 -1.26 -0.05 118.70 125.16 1i43 s GLU 393 Ca -0.05 0.92 -0.24 0.00 0.01 0.00 0.00 54.97 55.61 1i43 s GLU 393 Cb 0.19 -3.36 -0.09 0.00 -4.31 0.00 0.00 34.13 26.56 1i43 s GLU 393 CO 0.71 0.31 1.05 -1.12 0.01 0.00 0.00 175.26 176.21 1i43 s SER 394 N -0.07 6.79 0.03 -0.19 0.01 -1.26 -4.37 113.70 114.63 1i43 s SER 394 Ca 0.35 2.03 0.02 0.00 1.31 0.00 0.00 55.95 59.67 1i43 s SER 394 Cb -0.19 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.43 1i43 s SER 394 CO 0.20 -0.47 -0.07 -0.63 0.41 0.00 0.00 173.24 172.68 1i43 s ILE 395 N -1.65 0.51 0.10 1.44 1.01 -0.50 -0.45 121.20 121.66 1i43 s ILE 395 Ca 0.57 -0.77 0.03 0.00 0.00 0.00 0.00 60.65 60.49 1i43 s ILE 395 Cb -0.22 -0.53 -0.04 0.00 0.01 0.00 0.00 42.46 41.68 1i43 s ILE 395 CO 0.28 -0.19 -0.09 -0.69 0.00 0.00 0.00 174.94 174.25 1i43 s VAL 396 N -0.90 0.86 -0.15 2.92 1.01 0.67 -0.77 120.40 124.03 1i43 s VAL 396 Ca -0.05 -1.68 -0.33 0.00 0.00 0.00 0.00 61.98 59.91 1i43 s VAL 396 Cb -0.07 -1.40 0.13 0.00 0.00 0.00 0.00 36.38 35.05 1i43 s VAL 396 CO 0.00 -0.63 1.13 1.51 0.00 0.00 0.00 175.10 177.11 1i43 s ASP 397 N -2.55 -0.20 -0.64 3.32 -4.77 -1.13 -2.52 116.67 108.18 1i43 s ASP 397 Ca 0.06 0.03 -0.07 0.00 -3.30 0.00 0.00 52.55 49.27 1i43 s ASP 397 Cb -0.01 0.20 0.17 0.00 -1.09 0.00 0.00 42.92 42.19 1i43 s ASP 397 CO -0.01 -0.32 0.50 -1.10 0.70 0.00 0.00 175.17 174.95 1i43 s GLN 398 N -2.39 2.81 0.48 2.11 -0.21 -1.26 -1.46 119.66 119.74 1i43 s GLN 398 Ca 0.07 -2.34 0.42 0.00 0.02 0.00 0.00 55.36 53.54 1i43 s GLN 398 Cb -0.01 -3.96 1.51 0.00 1.00 0.00 0.00 33.01 31.55 1i43 s GLN 398 CO -0.05 -1.21 1.39 -2.30 -2.12 0.00 0.00 175.29 171.00 1i43 n PRO 399 N 3.94 -0.01 -0.16 2.91 -0.02 -1.26 0.11 135.00 140.52 1i43 n PRO 399 Ca 0.06 1.00 -0.08 0.00 -2.02 0.00 0.00 63.50 62.46 1i43 n PRO 399 Cb 0.41 -2.23 0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1i43 n PRO 399 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i43 h ALA 400 N 0.99 0.60 0.03 3.55 0.00 -1.83 -1.18 119.26 121.42 1i43 h ALA 400 Ca 0.83 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 55.48 1i43 h ALA 400 Cb 3.22 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 20.81 1i43 h ALA 400 CO -0.09 0.13 -0.91 0.82 0.00 0.00 0.00 179.25 179.20 1i43 h ILE 401 N 0.61 1.21 -0.96 0.00 2.04 0.47 -2.30 117.51 118.58 1i43 h ILE 401 Ca 0.16 -2.28 0.02 0.00 1.00 0.00 0.00 64.86 63.76 1i43 h ILE 401 Cb 0.07 2.69 -0.05 0.00 -0.74 0.00 0.00 36.82 38.79 1i43 h ILE 401 CO -0.02 0.49 0.64 0.24 0.00 0.00 0.00 178.15 179.50 1i43 h MET 402 N -0.83 1.23 0.00 2.37 2.86 -0.95 -3.30 114.93 116.30 1i43 h MET 402 Ca -0.23 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1i43 h MET 402 Cb 1.32 -0.28 0.00 0.00 0.06 0.00 0.00 31.60 32.70 1i43 h MET 402 CO -0.08 0.81 -0.10 0.43 1.06 0.00 0.00 176.91 179.03 1i43 n SER 403 N -4.41 0.67 -0.44 1.22 7.64 -0.46 -4.84 113.62 112.99 1i43 n SER 403 Ca 0.12 -1.63 0.00 0.00 1.01 0.00 0.00 58.87 58.37 1i43 n SER 403 Cb 0.05 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 1i43 n SER 403 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1i43 n TYR 404 N -0.25 0.00 0.29 1.43 4.02 -1.11 -4.88 117.16 116.67 1i43 n TYR 404 Ca 0.02 0.00 0.18 0.00 -0.01 0.00 0.00 57.90 58.09 1i43 n TYR 404 Cb 0.50 0.06 0.84 0.00 -0.02 0.00 0.00 39.34 40.71 1i43 n TYR 404 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 176.86 178.20 1i43 h TRP 405 N 0.00 0.00 0.00 -0.72 -0.00 -1.49 -2.29 115.95 111.44 1i43 h TRP 405 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1i43 h TRP 405 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.38 1i43 h TRP 405 CO -0.04 0.02 0.00 0.38 -0.00 0.00 0.00 178.44 178.80 1i43 h ASP 406 N 0.00 0.00 -2.37 2.65 2.03 -1.89 -3.45 116.42 113.39 1i43 h ASP 406 Ca -0.00 0.00 -0.45 0.00 -0.73 0.00 0.00 57.03 55.85 1i43 h ASP 406 Cb 0.36 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.87 1i43 h ASP 406 CO 0.00 0.00 -0.22 -0.76 -1.03 0.00 0.00 179.24 177.23 1i43 s LEU 407 N -5.30 3.87 0.44 0.15 1.43 -0.86 -5.09 118.68 113.32 1i43 s LEU 407 Ca 0.05 0.12 -0.15 0.00 -1.03 0.00 0.00 54.13 53.13 1i43 s LEU 407 Cb 0.09 -3.01 -0.08 0.00 0.03 0.00 0.00 46.19 43.22 1i43 s LEU 407 CO 0.53 -0.50 0.88 -0.94 0.23 0.00 0.00 176.35 176.55 1i43 s SER 408 N -4.16 6.64 0.35 2.29 1.04 -1.26 -4.83 113.70 113.77 1i43 s SER 408 Ca 0.45 1.40 0.14 0.00 0.48 0.00 0.00 55.95 58.41 1i43 s SER 408 Cb -0.10 -2.43 1.00 0.00 0.10 0.00 0.00 66.02 64.59 1i43 s SER 408 CO 0.34 -0.45 1.72 -0.61 0.98 0.00 0.00 173.24 175.22 1i43 h GLN 409 N 1.29 0.45 -0.27 4.02 4.15 -1.96 0.34 115.11 123.13 1i43 h GLN 409 Ca -0.47 -0.03 -0.19 0.00 0.77 0.00 0.00 58.65 58.73 1i43 h GLN 409 Cb 1.18 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.77 1i43 h GLN 409 CO 0.63 0.30 -0.57 0.66 -1.93 0.00 0.00 178.83 177.92 1i43 h SER 410 N 0.47 0.97 0.49 -0.69 4.64 -1.98 -1.33 113.55 116.12 1i43 h SER 410 Ca 0.66 -0.55 -0.12 0.00 -0.47 0.00 0.00 61.79 61.31 1i43 h SER 410 Cb 1.44 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 63.23 1i43 h SER 410 CO -0.45 1.34 -0.55 0.44 -0.87 0.00 0.00 176.83 176.74 1i43 h ASP 411 N 0.64 0.06 0.18 4.97 3.32 -1.22 -1.31 116.42 123.06 1i43 h ASP 411 Ca 0.01 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1i43 h ASP 411 Cb 1.18 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1i43 h ASP 411 CO 0.13 0.60 -0.08 0.03 -1.72 0.00 0.00 179.24 178.19 1i43 h ARG 412 N 0.05 -0.23 -0.01 3.56 3.08 -0.37 -2.76 114.38 117.70 1i43 h ARG 412 Ca -0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1i43 h ARG 412 Cb 0.98 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.08 1i43 h ARG 412 CO 0.07 0.14 0.02 0.00 -1.07 0.00 0.00 179.97 179.14 1i43 h ALA 413 N 0.05 1.46 0.00 0.04 0.00 -1.18 0.11 119.26 119.74 1i43 h ALA 413 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1i43 h ALA 413 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1i43 h ALA 413 CO 0.04 -0.03 0.08 -0.22 0.00 0.00 0.00 179.25 179.12 1i43 h LYS 414 N 0.00 0.00 -0.91 0.00 3.64 -0.92 -2.92 116.57 115.45 1i43 h LYS 414 Ca 0.01 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.03 1i43 h LYS 414 Cb 0.04 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 31.46 1i43 h LYS 414 CO -0.00 0.00 -1.14 0.66 -2.27 0.00 0.00 179.45 176.70 1i43 n TYR 415 N -2.37 1.40 0.00 1.91 4.01 0.02 -5.01 117.16 117.12 1i43 n TYR 415 Ca -0.02 -2.66 0.00 0.00 -0.16 0.00 0.00 57.90 55.06 1i43 n TYR 415 Cb 0.11 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 38.82 1i43 n TYR 415 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i43 n GLY 416 N -0.23 1.76 3.65 2.72 0.00 -1.10 -4.96 105.19 107.03 1i43 n GLY 416 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1i43 n GLY 416 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i43 s ILE 417 N -0.05 3.47 0.18 -0.61 -1.09 -1.22 -4.95 121.20 116.93 1i43 s ILE 417 Ca 0.00 0.55 0.09 0.00 -2.23 0.00 0.00 60.65 59.06 1i43 s ILE 417 Cb 0.00 -3.40 -0.04 0.00 -1.58 0.00 0.00 42.46 37.44 1i43 s ILE 417 CO 0.00 -0.10 -0.11 -0.04 -1.23 0.00 0.00 174.94 173.46 1i43 s MET 418 N 4.45 2.01 0.00 2.79 -1.94 -1.26 -3.52 119.30 121.84 1i43 s MET 418 Ca 0.78 -1.28 0.08 0.00 -1.71 0.00 0.00 55.69 53.55 1i43 s MET 418 Cb -0.33 -2.14 0.37 0.00 2.01 0.00 0.00 34.83 34.74 1i43 s MET 418 CO 0.32 0.43 1.16 -0.25 -0.01 0.00 0.00 175.02 176.67 1i43 n ASP 419 N 0.09 0.00 0.03 3.03 9.92 -1.26 -1.71 116.55 126.66 1i43 n ASP 419 Ca -0.11 0.29 -0.14 0.00 -0.53 0.00 0.00 54.79 54.29 1i43 n ASP 419 Cb 0.55 -0.36 -0.14 0.00 -0.64 0.00 0.00 41.12 40.53 1i43 n ASP 419 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1i43 h ASN 420 N 0.00 0.26 -2.28 -2.24 -0.26 -1.89 -3.35 115.58 105.82 1i43 h ASN 420 Ca 0.00 -0.41 -0.58 0.00 -0.56 0.00 0.00 56.30 54.75 1i43 h ASN 420 Cb 0.09 -0.09 0.05 0.00 -1.06 0.00 0.00 38.32 37.32 1i43 h ASN 420 CO 0.00 1.35 0.91 -0.11 -1.06 0.00 0.00 177.43 178.53 1i43 n LEU 421 N -3.35 3.36 -3.99 1.61 7.94 -0.69 -2.59 117.00 119.29 1i43 n LEU 421 Ca -0.17 1.05 -0.25 0.00 -1.11 0.00 0.00 56.01 55.53 1i43 n LEU 421 Cb 1.04 -1.44 -0.17 0.00 0.53 0.00 0.00 43.42 43.38 1i43 n LEU 421 CO 0.48 -0.15 -0.46 -0.69 -1.11 0.00 0.00 177.39 175.46 1i43 s VAL 422 N 1.77 1.08 -0.31 1.96 1.01 0.31 -4.10 120.40 122.12 1i43 s VAL 422 Ca 0.82 -0.42 -0.09 0.00 0.00 0.00 0.00 61.98 62.29 1i43 s VAL 422 Cb -0.64 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 34.72 1i43 s VAL 422 CO 0.40 0.35 0.13 -0.60 0.00 0.00 0.00 175.10 175.38 1i43 s ARG 423 N 0.91 3.22 -0.22 2.72 3.00 -0.54 -1.44 118.95 126.62 1i43 s ARG 423 Ca -0.10 -0.79 -0.07 0.00 -1.00 0.00 0.00 55.73 53.77 1i43 s ARG 423 Cb -0.15 -3.52 -0.03 0.00 0.00 0.00 0.00 34.95 31.25 1i43 s ARG 423 CO 0.01 -0.44 0.05 0.12 0.00 0.00 0.00 175.30 175.03 1i43 s PHE 424 N 1.57 3.12 -0.45 5.12 2.19 0.88 -2.82 117.98 127.60 1i43 s PHE 424 Ca 0.04 -0.26 -0.07 0.00 0.33 0.00 0.00 56.93 56.97 1i43 s PHE 424 Cb -0.17 -2.15 0.12 0.00 -1.31 0.00 0.00 43.02 39.51 1i43 s PHE 424 CO 0.05 -0.16 0.30 0.45 1.83 0.00 0.00 175.22 177.68 1i43 s SER 425 N 1.07 5.53 0.09 6.13 0.15 0.05 -0.37 113.70 126.34 1i43 s SER 425 Ca 0.04 -1.99 -0.31 0.00 0.70 0.00 0.00 55.95 54.39 1i43 s SER 425 Cb -0.14 -1.94 -0.08 0.00 -1.71 0.00 0.00 66.02 62.15 1i43 s SER 425 CO 0.03 -0.63 1.54 -0.36 1.20 0.00 0.00 173.24 175.02 1i43 s PHE 426 N 1.23 2.80 0.00 3.44 0.08 -0.95 -1.40 117.98 123.18 1i43 s PHE 426 Ca 0.07 0.59 0.00 0.00 0.12 0.00 0.00 56.93 57.71 1i43 s PHE 426 Cb -0.25 -3.85 0.00 0.00 -0.57 0.00 0.00 43.02 38.35 1i43 s PHE 426 CO -0.02 -3.26 0.00 0.41 -0.10 0.00 0.00 175.22 172.25 1i43 n GLY 427 N 3.79 -0.30 0.00 4.36 0.00 -1.26 -4.81 105.19 106.97 1i43 n GLY 427 Ca 0.14 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1i43 n GLY 427 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1i43 n VAL 428 N 0.00 0.35 -0.62 1.61 3.14 0.93 -4.57 118.33 119.17 1i43 n VAL 428 Ca 0.00 -0.53 -0.30 0.00 -2.96 0.00 0.00 64.34 60.54 1i43 n VAL 428 Cb 0.00 0.97 0.20 0.00 -1.06 0.00 0.00 33.84 33.95 1i43 n VAL 428 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1i43 n GLU 429 N -0.17 -1.29 -1.84 1.45 4.71 -1.26 -4.88 120.64 117.36 1i43 n GLU 429 Ca 0.00 -0.33 -0.42 0.00 -0.01 0.00 0.00 57.16 56.40 1i43 n GLU 429 Cb 0.19 -2.17 -0.02 0.00 -1.01 0.00 0.00 31.44 28.43 1i43 n GLU 429 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1i43 s ASP 430 N -2.39 6.46 0.08 1.62 2.15 -1.26 -4.89 116.67 118.44 1i43 s ASP 430 Ca 0.65 2.83 -0.19 0.00 0.43 0.00 0.00 52.55 56.27 1i43 s ASP 430 Cb -0.23 -2.62 -0.06 0.00 -0.30 0.00 0.00 42.92 39.71 1i43 s ASP 430 CO 0.63 -0.86 1.32 0.15 -0.17 0.00 0.00 175.17 176.23 1i43 h PHE 431 N 5.43 -1.01 -0.94 -5.34 3.04 -1.98 -1.97 116.94 114.17 1i43 h PHE 431 Ca -0.46 0.05 0.21 0.00 3.98 0.00 0.00 57.97 61.75 1i43 h PHE 431 Cb 1.21 0.48 -0.18 0.00 2.56 0.00 0.00 35.95 40.02 1i43 h PHE 431 CO 0.60 -0.28 -0.15 -0.44 -2.02 0.00 0.00 178.31 176.03 1i43 h ASP 432 N -0.21 -0.73 -0.53 0.41 3.32 -1.98 0.52 116.42 117.21 1i43 h ASP 432 Ca 0.05 0.27 0.01 0.00 0.02 0.00 0.00 57.03 57.38 1i43 h ASP 432 Cb 0.34 0.54 -0.03 0.00 0.22 0.00 0.00 39.33 40.40 1i43 h ASP 432 CO -0.37 -0.31 0.34 0.44 -1.72 0.00 0.00 179.24 177.62 1i43 h ASP 433 N 0.01 0.58 -0.11 6.45 3.32 -1.78 -0.41 116.42 124.47 1i43 h ASP 433 Ca 0.49 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.51 1i43 h ASP 433 Cb 0.83 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.24 1i43 h ASP 433 CO -0.93 0.42 -0.00 -0.07 -1.72 0.00 0.00 179.24 176.93 1i43 h LEU 434 N 0.69 0.19 -0.06 1.55 3.38 0.51 -2.29 115.31 119.28 1i43 h LEU 434 Ca 0.20 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.87 1i43 h LEU 434 Cb -0.05 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1i43 h LEU 434 CO -0.06 0.46 -0.06 0.50 0.09 0.00 0.00 178.44 179.37 1i43 h LYS 435 N -0.09 -0.08 -0.99 1.13 3.64 -0.16 -0.96 116.57 119.07 1i43 h LYS 435 Ca 0.03 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1i43 h LYS 435 Cb 0.37 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.14 1i43 h LYS 435 CO 0.01 -0.06 0.64 0.00 -2.27 0.00 0.00 179.45 177.77 1i43 h ALA 436 N 0.96 1.39 0.15 5.00 0.00 -1.09 -0.86 119.26 124.81 1i43 h ALA 436 Ca 0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1i43 h ALA 436 Cb 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1i43 h ALA 436 CO -0.11 0.40 -0.07 0.22 0.00 0.00 0.00 179.25 179.69 1i43 h ASP 437 N 1.14 -0.16 -0.95 0.00 3.58 -0.93 -0.02 116.42 119.07 1i43 h ASP 437 Ca 0.43 -0.19 0.06 0.00 0.42 0.00 0.00 57.03 57.76 1i43 h ASP 437 Cb 0.20 0.04 -0.07 0.00 1.72 0.00 0.00 39.33 41.23 1i43 h ASP 437 CO -0.18 0.10 0.60 0.40 -2.88 0.00 0.00 179.24 177.28 1i43 h ILE 438 N -0.43 1.07 -0.02 2.25 2.04 -0.80 -1.22 117.51 120.40 1i43 h ILE 438 Ca -0.02 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1i43 h ILE 438 Cb 0.34 -0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1i43 h ILE 438 CO 0.03 0.20 -0.01 -0.07 0.00 0.00 0.00 178.15 178.30 1i43 h LEU 439 N 1.09 0.04 -1.47 1.44 3.38 -1.09 -2.24 115.31 116.47 1i43 h LEU 439 Ca 0.41 -0.47 0.16 0.00 0.09 0.00 0.00 57.88 58.07 1i43 h LEU 439 Cb 0.17 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 1i43 h LEU 439 CO -0.17 0.50 0.55 -0.61 0.09 0.00 0.00 178.44 178.79 1i43 h GLN 440 N -0.42 0.49 0.14 1.13 -0.00 -0.69 -2.01 115.11 113.73 1i43 h GLN 440 Ca 0.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.65 58.62 1i43 h GLN 440 Cb 0.49 -0.11 0.00 0.00 0.00 0.00 0.00 27.48 27.86 1i43 h GLN 440 CO 0.00 0.32 -0.07 0.00 0.00 0.00 0.00 178.83 179.09 1i43 h ALA 441 N 1.62 -0.18 -0.55 3.38 0.00 -1.12 -3.21 119.26 119.20 1i43 h ALA 441 Ca 0.42 -0.22 0.16 0.00 0.00 0.00 0.00 54.91 55.27 1i43 h ALA 441 Cb 0.89 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1i43 h ALA 441 CO -0.16 -0.36 0.39 -0.07 0.00 0.00 0.00 179.25 179.05 1i43 h LEU 442 N -0.67 0.01 -0.58 0.00 3.38 -0.76 -1.93 115.31 114.76 1i43 h LEU 442 Ca -0.02 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1i43 h LEU 442 Cb 0.50 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1i43 h LEU 442 CO 0.03 0.01 0.38 0.44 0.09 0.00 0.00 178.44 179.39 1i43 h ASP 443 N 0.01 0.65 0.15 -0.43 5.19 -1.40 -1.97 116.42 118.61 1i43 h ASP 443 Ca 0.26 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.66 1i43 h ASP 443 Cb 1.03 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.38 1i43 h ASP 443 CO -0.01 0.46 0.00 0.28 -3.12 0.00 0.00 179.24 176.86 1i43 h SER 444 N 0.77 0.00 0.00 6.45 0.02 -1.45 -3.52 113.55 115.81 1i43 h SER 444 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1i43 h SER 444 Cb -0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1i43 h SER 444 CO -0.06 0.00 0.00 -0.38 -1.14 0.00 0.00 176.83 175.25